3-Chloro-N-(3-chloro-4-fluorophenyl)benzo(b)thiophene-2-carboxamide
TL;DR: 3-Chloro-N-(3-chloro-4-fluorophenyl)benzo(b)thiophene-2-carboxamide (CAS 314022-38-3) is a chemical compound with molecular formula C15H8Cl2FNOS and molecular weight 338.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-(3-chloro-4-fluorophenyl)-1-benzothiophene-2-carboxamide
Also Known As: 3-chloro-N-(3-chloro-4-fluorophenyl)-1-benzothiophene-2-carboxamide, BAS 00483427, 3-Chloro-N-(3-chloro-4-fluorophenyl)benzo[b]thiophene-2-carboxamide, 3-Chloro-N-(3-chloro-4-fluorophenyl)benzo(b)thiophene-2-carboxamide, (3-chlorobenzo[b]thiophen-2-yl)-N-(3-chloro-4-fluorophenyl)carboxamide
| Molecular Formula | C15H8Cl2FNOS |
|---|---|
| Molecular Weight | 338.97 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 57.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 338.96878 |
| Heavy Atoms | 21 |
| Complexity | 400.0 |
Chemical Identifiers
| CAS Number | 314022-38-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C(S2)C(=O)NC3=CC(=C(C=C3)F)Cl)Cl |
| InChIKey | CDUPBNCHNDLKRZ-UHFFFAOYSA-N |
Product Overview
3-Chloro-N-(3-chloro-4-fluorophenyl)benzo(b)thiophene-2-carboxamide (CAS 314022-38-3), with molecular formula C15H8Cl2FNOS and molecular weight 338.97 g/mol. IUPAC: 3-chloro-N-(3-chloro-4-fluorophenyl)-1-benzothiophene-2-carboxamide.
Chemical Property Profile of 3-Chloro-N-(3-chloro-4-fluorophenyl)benzo(b)thiophene-2-carboxamide
Property Insights of 3-Chloro-N-(3-chloro-4-fluorophenyl)benzo(b)thiophene-2-carboxamide
The XLogP value of 5.5 indicates that 3-Chloro-N-(3-chloro-4-fluorophenyl)benzo(b)thiophene-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.3 Ų, 3-Chloro-N-(3-chloro-4-fluorophenyl)benzo(b)thiophene-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-N-(3-chloro-4-fluorophenyl)benzo(b)thiophene-2-carboxamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Chloro-N-(3-chloro-4-fluorophenyl)benzo(b)thiophene-2-carboxamide?
The CAS number of 3-Chloro-N-(3-chloro-4-fluorophenyl)benzo(b)thiophene-2-carboxamide is 314022-38-3.
What is the molecular formula of 3-Chloro-N-(3-chloro-4-fluorophenyl)benzo(b)thiophene-2-carboxamide?
The molecular formula of 3-Chloro-N-(3-chloro-4-fluorophenyl)benzo(b)thiophene-2-carboxamide is C15H8Cl2FNOS.
What is the molecular weight of 3-Chloro-N-(3-chloro-4-fluorophenyl)benzo(b)thiophene-2-carboxamide?
The molecular weight of 3-Chloro-N-(3-chloro-4-fluorophenyl)benzo(b)thiophene-2-carboxamide is 338.97 g/mol.
Where can I buy 3-Chloro-N-(3-chloro-4-fluorophenyl)benzo(b)thiophene-2-carboxamide?
You can request a quote for 3-Chloro-N-(3-chloro-4-fluorophenyl)benzo(b)thiophene-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-N-(3-chloro-4-fluorophenyl)benzo(b)thiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-N-(3-chloro-4-fluorophenyl)benzo(b)thiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.