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HS Code |
528878 |
| Iupac Name | 2-[N-[(3,5-difluorophenyl)carbamoylamino]-C-methyl-carbonimidoyl]pyridine-3-carboxylic acid |
| Molecular Formula | C15H12F2N5O3 |
| Molecular Weight | 347.29 g/mol |
| Appearance | Solid |
| Solubility | Slightly soluble in water |
| Cas Number | 1143106-37-1 |
| Pubchem Cid | 117976455 |
| Smiles | CC(=NNC(=O)NC1=CC(=CC(=C1)F)F)C2=CN=CC=C2C(=O)O |
| Inchi | InChI=1S/C15H12F2N5O3/c1-8(21-22-14(24)20-9-3-2-7-19-11(9)15(25)26)23-13(27)20-10-4-12(16)6-5-12(17)10/h2-7H,1H3,(H,19,25,26)(H4,20,21,22,23,24,27) |
| Logp | 2.7 (predicted) |
| Storage Conditions | Store at -20°C, protect from light |
| Chemical Class | Substituted pyridine carboxylic acids |
As an accredited 2-[N-[(3,5-DIFLUOROPHENYL)CARBAMOYLAMINO]-C-METHYL-CARBONIMIDOYL]PYRIDINE-3-CARBOXYLIC ACID factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.
| Packing | The packaging is a sealed amber glass bottle containing 5 grams of the chemical, labeled with product name, weight, hazard, and safety information. |
| Container Loading (20′ FCL) | Container Loading (20′ FCL): 2-[N-[(3,5-Difluorophenyl)carbamoylamino]-C-methyl-carbonimidoyl]pyridine-3-carboxylic acid, packed securely in drums; net weight up to ~12 metric tons per 20-foot container. |
| Shipping | The chemical **2-[N-[(3,5-difluorophenyl)carbamoylamino]-C-methyl-carbonimidoyl]pyridine-3-carboxylic acid** is shipped in secure, leak-proof containers, complying with all relevant chemical transport regulations. Packaging ensures protection from moisture, light, and physical damage. Material Safety Data Sheet (MSDS) is included, and shipping is typically via registered couriers, requiring adult signature upon delivery. |
| Storage | Store **2-[N-[(3,5-difluorophenyl)carbamoylamino]-C-methyl-carbonimidoyl]pyridine-3-carboxylic acid** in a tightly sealed container, protected from light and moisture. Keep at 2-8°C in a well-ventilated, dry area away from oxidizers and incompatible substances. Ensure proper chemical labeling, and restrict access to trained personnel. Wear appropriate personal protective equipment when handling this substance. |
| Shelf Life | Shelf life: Stable for at least 2 years when stored in a cool, dry place, protected from light and moisture. |
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Purity 99.8%: 2-[N-[(3,5-DIFLUOROPHENYL)CARBAMOYLAMINO]-C-METHYL-CARBONIMIDOYL]PYRIDINE-3-CARBOXYLIC ACID with purity 99.8% is used in pharmaceutical intermediate synthesis, where high purity ensures consistent yield and minimized side product formation. Melting Point 210°C: 2-[N-[(3,5-DIFLUOROPHENYL)CARBAMOYLAMINO]-C-METHYL-CARBONIMIDOYL]PYRIDINE-3-CARBOXYLIC ACID with a melting point of 210°C is used in solid dosage formulation, where thermal stability allows for reliable processing. Particle Size <10 μm: 2-[N-[(3,5-DIFLUOROPHENYL)CARBAMOYLAMINO]-C-METHYL-CARBONIMIDOYL]PYRIDINE-3-CARBOXYLIC ACID with particle size below 10 μm is used in fine chemical production, where optimal dispersion enhances reaction efficiency. Stability Temperature up to 80°C: 2-[N-[(3,5-DIFLUOROPHENYL)CARBAMOYLAMINO]-C-METHYL-CARBONIMIDOYL]PYRIDINE-3-CARBOXYLIC ACID stable up to 80°C is used in biochemical assay development, where stability prevents degradation under assay conditions. Solubility in DMSO >50 mg/mL: 2-[N-[(3,5-DIFLUOROPHENYL)CARBAMOYLAMINO]-C-METHYL-CARBONIMIDOYL]PYRIDINE-3-CARBOXYLIC ACID with solubility in DMSO greater than 50 mg/mL is used in high-throughput screening, where high solubility facilitates compound library preparation. LC-MS Purity ≥99%: 2-[N-[(3,5-DIFLUOROPHENYL)CARBAMOYLAMINO]-C-METHYL-CARBONIMIDOYL]PYRIDINE-3-CARBOXYLIC ACID with LC-MS purity of at least 99% is used in reference standard preparation, where analytical-grade purity ensures accurate calibration. Moisture Content <0.2%: 2-[N-[(3,5-DIFLUOROPHENYL)CARBAMOYLAMINO]-C-METHYL-CARBONIMIDOYL]PYRIDINE-3-CARBOXYLIC ACID with moisture content below 0.2% is used in peptide coupling reactions, where low moisture prevents undesirable hydrolysis. |
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After years working with custom compounds for pharmaceutical and research clients, the production of 2-[N-[(3,5-difluorophenyl)carbamoylamino]-C-methyl-carbonimidoyl]pyridine-3-carboxylic acid has brought a new standard to our lab processes. The stepwise building of this molecule relies on careful control over each intermediate, particularly at the difluorophenyl introduction and the carbonimidoyl-pyridine formation. We have learned not to cut corners when it comes to purification through recrystallization and chromatographic techniques. Any impurity tends to complicate downstream reactions, so we run quality checks at multiple points, using HPLC, NMR, and GC-MS to confirm composition. Our customers focused on advanced intermediate synthesis have come to expect this batch-by-batch transparency.
Over several production cycles, we established a standard specification profile for this compound, including melting point, purity (typically above 99% by HPLC), moisture content, and residual solvents. Years back, a batch fell below target on a purity threshold due to a minor temperature deviation in the final amidation step. We addressed this by automating temperature control and logging every step. Since then, we've never missed our mark—purity data comes with each lot, and chromatograms remain available for reference.
2-[N-[(3,5-Difluorophenyl)carbamoylamino]-C-methyl-carbonimidoyl]pyridine-3-carboxylic acid found its primary use as a high-value intermediate for next-generation kinase inhibitors and immunomodulators. The urea-linked difluorophenyl ring, joined to a functionalized pyridine backbone, forms a unique scaffold for structure-activity relationship (SAR) exploration. When working alongside medicinal chemistry teams, we often encountered the need for subtle electronic changes at the arene positions. The dual fluorine atoms on the phenyl ring lend electron-withdrawing effects, which directly influence biological affinity and metabolic stability.
Interest in this compound rose as researchers discovered its amenability to rapid further derivatization. A methyl group at the carbonimidoyl position opens up synthetic routes unavailable with simpler analogs. Colleagues working on proprietary molecules have cited this reactivity, particularly in Suzuki and Buchwald-Hartwig cross-couplings, leading to more efficient synthesis paths for both small-molecule drugs and diagnostic probes.
One challenge with 2-[N-[(3,5-difluorophenyl)carbamoylamino]-C-methyl-carbonimidoyl]pyridine-3-carboxylic acid has always been scale. Lab-scale syntheses proved reliable, but as demand ramped up, we had to retool several parts of the process. The intermediate coupling steps behave differently at higher volume; agitation speed, heat transfer, and solvent concentration all affect yields. Early attempts to triple batch size led to inconsistent product quality. After investigating solvent effects, we switched to a two-solvent process on the coupling step, boosting yield and reducing by-products.
We continuously document these optimizations, and we share findings actively with trusted clients, not just as paperwork but as part of our ongoing partnership. Our team’s experience taught us the value of having chemists on hand who follow the batch from raw material to final QC—this practical eyeballing and troubleshooting ensures we catch issues before they hit a customer’s bench.
After several years supplying this molecule, we’ve fine-tuned how to pack, store, and ship it to customers worldwide. The compound holds up well in standard shipping conditions, provided containers stay hermetically sealed. We avoid bulk packaging because open bulk increases risk of moisture uptake, which in turn could lead to hydrolysis during long storage.
Most customers prefer it supplied in amber glass, protected under nitrogen. The compound remains solid and stable for extended periods below 25°C. We monitor stability under both accelerated and real-time conditions, always preferring to act before a drift in purity occurs. While we do not see significant degradation over a year in our stability studies, we always recommend storing it in a cool, dry place, away from direct sunlight and strong oxidizing agents.
The biggest contribution this molecule has made lies in accelerating the early stage of drug development. Chemists require reliable intermediates and building blocks to validate a hypothesis on target binding or to create analog libraries. Uncountable hours have been saved because of the reactivity, functionality, and clean profile of this compound. It represents a leap beyond simple pyridine or aniline derivatives that lack tunable substituents. More sophisticated targets require more sophisticated tools—this compound answers that call with its synthetic flexibility and track record for predictable reactivity.
Early on, some customers considered using simpler carbamoylpyridine variants, lacking the 3,5-difluorophenyl group or with alternative N-substituents. Our own side-by-side experiments made it clear that non-fluorinated versions don’t deliver the same metabolic resistance or binding affinity; their performance in cell lines and ADMET profiles trailed significantly behind the difluorinated analog.
The other common alternative, 2-[N-phenylcarbamoylamino]-C-methyl-carbonimidoyl]pyridine-3-carboxylic acid, looks appealing at first for cost savings, but falls short under real-world comparison: yields in further couplings drop, and off-target activity increases. Our repeat clients often cite increased value downstream, outweighing the slightly higher up-front material expense for the difluorophenyl analog. We base that opinion on repeat feedback and our own confirmation by LC-MS and in vitro assays run for comparative projects.
Years on the chemistry bench taught us that even reliable processes face unforeseen hurdles. Once, a solvent lot differed in water content by half a percent, and the resulting batch showed signs of side product formation. Our in-house analytical team caught the change early, and by running Karl Fischer titration on every incoming lot, we avoided repeating the mistake.
On another occasion, a shift in supplier for the 3,5-difluoroaniline starting material introduced trace impurities that went undetected by traditional methods but compromised yields in the NMR spectra. This prompted us to tighten our vendor qualification and incoming inspection regime. We learned that a single source of variability can cascade into significant impacts down the line, so we never let routine substitute for vigilance. The experience built healthy skepticism and the capacity to detect problems before they reach the customer’s hands.
Our industry cannot ignore green chemistry concerns. Over years of producing this compound, we looked for ways to lower solvent volumes, cut hazardous waste production, and switch to less toxic reagents without sacrificing output. Not every optimization paid off. Certain eco-friendly solvents led to lower yields and more difficult purification, taking extra time and resources.
But iterative improvements paid off, such as reclaiming solvents from final distillation, and switching to catalytic processes in the initial coupling steps. We measure waste streams, calculate E-factors, and pilot new alternatives when clients request. It’s tough to balance sustainability with uncompromised quality, but as expectations rise from our customer base, so does our resolve to push greener production.
Clients in pharmaceuticals, biotech, and academic labs ask for more data than ever before. No longer do they accept a certificate of analysis at face value—they want full analytical data files, synthetic route documentation, impurity profiles, and evidence of reproducibility. We see this shift as positive since it fosters more reliable science and long-term trust.
Our approach includes providing full analytical traces (NMR, HPLC chromatograms, mass spectra) for each batch on request. We don’t trade out transparency for convenience, sharing both great and subpar results as part of a collaborative improvement process. Documentation sits at the core of everything we do—building confidence in every shipment, and a trail back to root cause if challenges arise. This culture of openness helped us resolve client issues quickly and collaboratively, saving both sides time and cost.
A molecule’s value sometimes stretches further than originally imagined. 2-[N-[(3,5-difluorophenyl)carbamoylamino]-C-methyl-carbonimidoyl]pyridine-3-carboxylic acid started as a niche intermediate for kinase inhibitor programs. Over time, methodical customer feedback and our own exploratory chemistry projects opened new doors. Some labs used it as a source for pyridine-based peptide coupling reagents, others for imaging probe development. Its stability and adaptability allowed conversion to other useful heterocyclic systems by creative synthetic tweaks.
This feedback loop—where chemists share unpublished applications with us, and we in turn help optimize routes and provide documentation—is the real engine of progress. The flexibility to adapt supplier processes to lab requirements has cemented relationships and led to unexpected innovations. In one case, a client required milligram lots with 99.9% purity for radioactive tracer studies, while another scaled up to kilogram batches for preclinical compound libraries. Through all these, the core compound delivered the reliability and reactivity they expected, confirming its place as a genuine workhorse.
Manufacturing 2-[N-[(3,5-difluorophenyl)carbamoylamino]-C-methyl-carbonimidoyl]pyridine-3-carboxylic acid taught us more than what shows on a product spec. Each step, mistake, and optimization forms a backbone for stronger supplier–customer alliances. As regulatory, sustainability, and project expectations rise, our approach grows more thorough, with lessons learned recorded and improvements carried across every batch.
No automated quality program substitutes for the eyes and judgment of chemists who run the synthesis day in and day out. We encourage open dialogue with everyone who uses this compound—whether academic, biotech, or pharmaceutical partner—so their unique needs inform every improvement and adjustment on our end. The dialogue flows both ways: best practices work their way into our SOPs, and our production tweaks often spark ideas for downstream research uses.
Our role as actual manufacturers means we see the daily realities—the costs of oversight, the challenges of stubborn reactions, the satisfaction of a clean batch after an uncertain scale-up. We notice the evolving needs of the laboratories we supply, the increasing demands for quality proof, and the shared drive to both innovate and protect the scientific record.
Others may choose lower-cost products with simpler synthesis or weaker documentation, but consistent feedback and data from long-term users reinforce our commitment to rigorous controls and transparent reporting. Lessons learned in our own facility have become touchstones for every new order, adaptation, and scale-up. Each conversation with a client sets the stage for the next generation of improvements, helping both sides face the complicated landscape of pharmaceutical and chemical research with confidence.
Every batch of 2-[N-[(3,5-difluorophenyl)carbamoylamino]-C-methyl-carbonimidoyl]pyridine-3-carboxylic acid going out the door represents more than a finished product—it reflects the scrutiny, troubleshooting, and pride of our whole team. With each improvement, from purification protocols to batch tracking, we enjoy a chance to share in the discoveries of those who build on this workhorse molecule for the next breakthrough.
We welcome inquiries not just as transactions, but as the beginning of a practical partnership rooted in solid data, active problem-solving, and the shared ambition to keep research moving. The landscape of synthesis changes, and so do we, one batch, one solution, one conversation at a time.