Methyl 5-phenyl-2-(3-pyridylcarbonylamino)thiophene-3-carboxylate
TL;DR: Methyl 5-phenyl-2-(3-pyridylcarbonylamino)thiophene-3-carboxylate (CAS 379250-86-9) is a chemical compound with molecular formula C18H14N2O3S and molecular weight 338.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-phenyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate
Also Known As: BAS 04282496, methyl 2-(nicotinamido)-5-phenylthiophene-3-carboxylate, methyl 5-phenyl-2-(3-pyridylcarbonylamino)thiophene-3-carboxylate, methyl 5-phenyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate, METHYL 5-PHENYL-2-[(3-PYRIDYLCARBONYL)AMINO]-3-THIOPHENECARBOXYLATE
| Molecular Formula | C18H14N2O3S |
|---|---|
| Molecular Weight | 338.07 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 96.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 338.0725 |
| Heavy Atoms | 24 |
| Complexity | 454.0 |
Chemical Identifiers
| CAS Number | 379250-86-9 |
|---|---|
| SMILES | COC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C3=CN=CC=C3 |
| InChIKey | NBOUOHAOSVOZLC-UHFFFAOYSA-N |
Product Overview
Methyl 5-phenyl-2-(3-pyridylcarbonylamino)thiophene-3-carboxylate (CAS 379250-86-9), with molecular formula C18H14N2O3S and molecular weight 338.07 g/mol. IUPAC: methyl 5-phenyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate.
Chemical Property Profile of Methyl 5-phenyl-2-(3-pyridylcarbonylamino)thiophene-3-carboxylate
Property Insights of Methyl 5-phenyl-2-(3-pyridylcarbonylamino)thiophene-3-carboxylate
The XLogP value of 3.8 indicates that Methyl 5-phenyl-2-(3-pyridylcarbonylamino)thiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 5-phenyl-2-(3-pyridylcarbonylamino)thiophene-3-carboxylate. Following Lipinski's Rule of Five, Methyl 5-phenyl-2-(3-pyridylcarbonylamino)thiophene-3-carboxylate has 1 hydrogen bond donor(s) and 5 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-phenyl-2-(3-pyridylcarbonylamino)thiophene-3-carboxylate?
The CAS number of Methyl 5-phenyl-2-(3-pyridylcarbonylamino)thiophene-3-carboxylate is 379250-86-9.
What is the molecular formula of Methyl 5-phenyl-2-(3-pyridylcarbonylamino)thiophene-3-carboxylate?
The molecular formula of Methyl 5-phenyl-2-(3-pyridylcarbonylamino)thiophene-3-carboxylate is C18H14N2O3S.
What is the molecular weight of Methyl 5-phenyl-2-(3-pyridylcarbonylamino)thiophene-3-carboxylate?
The molecular weight of Methyl 5-phenyl-2-(3-pyridylcarbonylamino)thiophene-3-carboxylate is 338.07 g/mol.
Where can I buy Methyl 5-phenyl-2-(3-pyridylcarbonylamino)thiophene-3-carboxylate?
You can request a quote for Methyl 5-phenyl-2-(3-pyridylcarbonylamino)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-phenyl-2-(3-pyridylcarbonylamino)thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-phenyl-2-(3-pyridylcarbonylamino)thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.