![methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)-4-(pyridin-3-yl)thiophene-3-carboxylate structure](/static/products/7745/774575-03-0.webp)
methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)-4-(pyridin-3-yl)thiophene-3-carboxylate
TL;DR: methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)-4-(pyridin-3-yl)thiophene-3-carboxylate (CAS 774575-03-0) is a chemical compound with molecular formula C20H13ClN2O3S2 and molecular weight 428.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-4-pyridin-3-ylthiophene-3-carboxylate
Also Known As: methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)-4-(pyridin-3-yl)thiophene-3-carboxylate, methyl 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-4-pyridin-3-ylthiophene-3-carboxylate, methyl 2-[(3-chlorobenzo[b]thiophen-2-yl)carbonylamino]-4-(3-pyridyl)thiophene -3-carboxylate, methyl 2-{[(3-chloro-1-benzothiophen-2-yl)carbonyl]amino}-4-(pyridin-3-yl)thiophene-3-carboxylate
| Molecular Formula | C20H13ClN2O3S2 |
|---|---|
| Molecular Weight | 428.01 g/mol |
| LogP | 5.7171 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 428.0056 |
| Heavy Atoms | 28 |
| Complexity | 1184.8643 |
Chemical Identifiers
| CAS Number | 774575-03-0 |
|---|---|
| SMILES | COC(=O)C1=C(SC=C1C2=CN=CC=C2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl |
Product Overview
methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)-4-(pyridin-3-yl)thiophene-3-carboxylate (CAS 774575-03-0), with molecular formula C20H13ClN2O3S2 and molecular weight 428.01 g/mol. IUPAC: methyl 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-4-pyridin-3-ylthiophene-3-carboxylate.
Chemical Property Profile of methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)-4-(pyridin-3-yl)thiophene-3-carboxylate
Property Insights of methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)-4-(pyridin-3-yl)thiophene-3-carboxylate
The XLogP value of 5.7171 indicates that methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)-4-(pyridin-3-yl)thiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)-4-(pyridin-3-yl)thiophene-3-carboxylate. Following Lipinski's Rule of Five, methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)-4-(pyridin-3-yl)thiophene-3-carboxylate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)-4-(pyridin-3-yl)thiophene-3-carboxylate?
The CAS number of methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)-4-(pyridin-3-yl)thiophene-3-carboxylate is 774575-03-0.
What is the molecular formula of methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)-4-(pyridin-3-yl)thiophene-3-carboxylate?
The molecular formula of methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)-4-(pyridin-3-yl)thiophene-3-carboxylate is C20H13ClN2O3S2.
What is the molecular weight of methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)-4-(pyridin-3-yl)thiophene-3-carboxylate?
The molecular weight of methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)-4-(pyridin-3-yl)thiophene-3-carboxylate is 428.01 g/mol.
Where can I buy methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)-4-(pyridin-3-yl)thiophene-3-carboxylate?
You can request a quote for methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)-4-(pyridin-3-yl)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 2-(3-chlorobenzo[b]thiophene-2-carboxamido)-4-(pyridin-3-yl)thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-(3-chlorobenzo[b]thiophene-2-carboxamido)-4-(pyridin-3-yl)thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.