![methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate structure](/static/products/4953/495382-88-2.webp)
methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate
TL;DR: methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate (CAS 495382-88-2) is a chemical compound with molecular formula C20H16ClN3O4S and molecular weight 429.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate
Also Known As: methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate, methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-[(pyridin-3-ylcarbonyl)amino]thiophene-3-carboxylate, methyl 5-((4-chlorophenyl)carbamoyl)-4-methyl-2-(nicotinamido)thiophene-3-carboxylate, METHYL 5-[(4-CHLOROANILINO)CARBONYL]-4-METHYL-2-[(3-PYRIDYLCARBONYL)AMINO]-3-THIOPHENECARBOXYLATE, methyl 5-[(4-chloroanilino)carbonyl]-4-methyl-2-[(pyridin-3-ylcarbonyl)amino]thiophene-3-carboxylate
| Molecular Formula | C20H16ClN3O4S |
|---|---|
| Molecular Weight | 429.06 g/mol |
| LogP | 4.39612 |
| Topological Polar Surface Area | 97.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 429.055 |
| Heavy Atoms | 29 |
| Complexity | 1065.3353 |
Chemical Identifiers
| CAS Number | 495382-88-2 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CN=CC=C2)C(=O)NC3=CC=C(C=C3)Cl |
Product Overview
methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate (CAS 495382-88-2), with molecular formula C20H16ClN3O4S and molecular weight 429.06 g/mol. IUPAC: methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate.
Chemical Property Profile of methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate
Property Insights of methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate
The XLogP value of 4.39612 indicates that methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.39 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate. Following Lipinski's Rule of Five, methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate?
The CAS number of methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate is 495382-88-2.
What is the molecular formula of methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate?
The molecular formula of methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate is C20H16ClN3O4S.
What is the molecular weight of methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate?
The molecular weight of methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate is 429.06 g/mol.
Where can I buy methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate?
You can request a quote for methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.