3-chloro-N-(4-fluorophenyl)-6-methoxy-1-benzothiophene-2-carboxamide
TL;DR: 3-chloro-N-(4-fluorophenyl)-6-methoxy-1-benzothiophene-2-carboxamide (CAS 443673-73-2) is a chemical compound with molecular formula C16H11ClFNO2S and molecular weight 335.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-(4-fluorophenyl)-6-methoxy-1-benzothiophene-2-carboxamide
Also Known As: BAS 04877624, 3-chloro-N-(4-fluorophenyl)-6-methoxy-1-benzothiophene-2-carboxamide, AN-329/15576568, (3-chloro-6-methoxybenzo[b]thiophen-2-yl)-N-(4-fluorophenyl)carboxamide, 3-Chloro-6-methoxy-benzo[b]thiophene-2-carboxylic acid (4-fluoro-phenyl)-amide
| Molecular Formula | C16H11ClFNO2S |
|---|---|
| Molecular Weight | 335.02 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 66.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 335.0183 |
| Heavy Atoms | 22 |
| Complexity | 406.0 |
Chemical Identifiers
| CAS Number | 443673-73-2 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C(=C(S2)C(=O)NC3=CC=C(C=C3)F)Cl |
| InChIKey | ZLARYBPXHBCVJV-UHFFFAOYSA-N |
Product Overview
3-chloro-N-(4-fluorophenyl)-6-methoxy-1-benzothiophene-2-carboxamide (CAS 443673-73-2), with molecular formula C16H11ClFNO2S and molecular weight 335.02 g/mol. IUPAC: 3-chloro-N-(4-fluorophenyl)-6-methoxy-1-benzothiophene-2-carboxamide.
Chemical Property Profile of 3-chloro-N-(4-fluorophenyl)-6-methoxy-1-benzothiophene-2-carboxamide
Property Insights of 3-chloro-N-(4-fluorophenyl)-6-methoxy-1-benzothiophene-2-carboxamide
The XLogP value of 4.8 indicates that 3-chloro-N-(4-fluorophenyl)-6-methoxy-1-benzothiophene-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-chloro-N-(4-fluorophenyl)-6-methoxy-1-benzothiophene-2-carboxamide. Following Lipinski's Rule of Five, 3-chloro-N-(4-fluorophenyl)-6-methoxy-1-benzothiophene-2-carboxamide has 1 hydrogen bond donor(s) and 4 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 3-chloro-N-(4-fluorophenyl)-6-methoxy-1-benzothiophene-2-carboxamide?
The CAS number of 3-chloro-N-(4-fluorophenyl)-6-methoxy-1-benzothiophene-2-carboxamide is 443673-73-2.
What is the molecular formula of 3-chloro-N-(4-fluorophenyl)-6-methoxy-1-benzothiophene-2-carboxamide?
The molecular formula of 3-chloro-N-(4-fluorophenyl)-6-methoxy-1-benzothiophene-2-carboxamide is C16H11ClFNO2S.
What is the molecular weight of 3-chloro-N-(4-fluorophenyl)-6-methoxy-1-benzothiophene-2-carboxamide?
The molecular weight of 3-chloro-N-(4-fluorophenyl)-6-methoxy-1-benzothiophene-2-carboxamide is 335.02 g/mol.
Where can I buy 3-chloro-N-(4-fluorophenyl)-6-methoxy-1-benzothiophene-2-carboxamide?
You can request a quote for 3-chloro-N-(4-fluorophenyl)-6-methoxy-1-benzothiophene-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-(4-fluorophenyl)-6-methoxy-1-benzothiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-N-(4-fluorophenyl)-6-methoxy-1-benzothiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.