N-(4-carbamoylphenyl)-3-chloro-6-methyl-1-benzothiophene-2-carboxamide
TL;DR: N-(4-carbamoylphenyl)-3-chloro-6-methyl-1-benzothiophene-2-carboxamide (CAS 354546-87-5) is a chemical compound with molecular formula C17H13ClN2O2S and molecular weight 344.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-carbamoylphenyl)-3-chloro-6-methyl-1-benzothiophene-2-carboxamide
Also Known As: N-(4-carbamoylphenyl)-3-chloro-6-methyl-1-benzothiophene-2-carboxamide, N-[4-(aminocarbonyl)phenyl]-3-chloro-6-methyl-1-benzothiophene-2-carboxamide, N~2~-[4-(AMINOCARBONYL)PHENYL]-3-CHLORO-6-METHYL-1-BENZOTHIOPHENE-2-CARBOXAMIDE
| Molecular Formula | C17H13ClN2O2S |
|---|---|
| Molecular Weight | 344.04 g/mol |
| LogP | 4.21432 |
| Topological Polar Surface Area | 72.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 344.03864 |
| Heavy Atoms | 23 |
| Complexity | 916.2381 |
Chemical Identifiers
| CAS Number | 354546-87-5 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)C(=C(S2)C(=O)NC3=CC=C(C=C3)C(=O)N)Cl |
Product Overview
N-(4-carbamoylphenyl)-3-chloro-6-methyl-1-benzothiophene-2-carboxamide (CAS 354546-87-5), with molecular formula C17H13ClN2O2S and molecular weight 344.04 g/mol. IUPAC: N-(4-carbamoylphenyl)-3-chloro-6-methyl-1-benzothiophene-2-carboxamide.
Chemical Property Profile of N-(4-carbamoylphenyl)-3-chloro-6-methyl-1-benzothiophene-2-carboxamide
Property Insights of N-(4-carbamoylphenyl)-3-chloro-6-methyl-1-benzothiophene-2-carboxamide
The XLogP value of 4.21432 indicates that N-(4-carbamoylphenyl)-3-chloro-6-methyl-1-benzothiophene-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.19 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-carbamoylphenyl)-3-chloro-6-methyl-1-benzothiophene-2-carboxamide. Following Lipinski's Rule of Five, N-(4-carbamoylphenyl)-3-chloro-6-methyl-1-benzothiophene-2-carboxamide has 2 hydrogen bond donor(s) and 3 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 N-(4-carbamoylphenyl)-3-chloro-6-methyl-1-benzothiophene-2-carboxamide?
The CAS number of N-(4-carbamoylphenyl)-3-chloro-6-methyl-1-benzothiophene-2-carboxamide is 354546-87-5.
What is the molecular formula of N-(4-carbamoylphenyl)-3-chloro-6-methyl-1-benzothiophene-2-carboxamide?
The molecular formula of N-(4-carbamoylphenyl)-3-chloro-6-methyl-1-benzothiophene-2-carboxamide is C17H13ClN2O2S.
What is the molecular weight of N-(4-carbamoylphenyl)-3-chloro-6-methyl-1-benzothiophene-2-carboxamide?
The molecular weight of N-(4-carbamoylphenyl)-3-chloro-6-methyl-1-benzothiophene-2-carboxamide is 344.04 g/mol.
Where can I buy N-(4-carbamoylphenyl)-3-chloro-6-methyl-1-benzothiophene-2-carboxamide?
You can request a quote for N-(4-carbamoylphenyl)-3-chloro-6-methyl-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 N-(4-carbamoylphenyl)-3-chloro-6-methyl-1-benzothiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-carbamoylphenyl)-3-chloro-6-methyl-1-benzothiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.