N-(2-carbamoylphenyl)-5-nitro-1-benzothiophene-2-carboxamide
TL;DR: N-(2-carbamoylphenyl)-5-nitro-1-benzothiophene-2-carboxamide (CAS 690693-02-8) is a chemical compound with molecular formula C16H11N3O4S and molecular weight 341.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-carbamoylphenyl)-5-nitro-1-benzothiophene-2-carboxamide
Also Known As: Gtfs inhibitor G43, Gtfs inhibitor #G43, EX-A7997M, G43, US11866416, Compound SN-I-204
| Molecular Formula | C16H11N3O4S |
|---|---|
| Molecular Weight | 341.05 g/mol |
| LogP | 3.1607 |
| Topological Polar Surface Area | 115.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 341.04703 |
| Heavy Atoms | 24 |
| Complexity | 980.3679 |
Chemical Identifiers
| CAS Number | 690693-02-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)N)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-] |
Product Overview
N-(2-carbamoylphenyl)-5-nitro-1-benzothiophene-2-carboxamide (CAS 690693-02-8), with molecular formula C16H11N3O4S and molecular weight 341.05 g/mol. IUPAC: N-(2-carbamoylphenyl)-5-nitro-1-benzothiophene-2-carboxamide.
Chemical Property Profile of N-(2-carbamoylphenyl)-5-nitro-1-benzothiophene-2-carboxamide
Property Insights of N-(2-carbamoylphenyl)-5-nitro-1-benzothiophene-2-carboxamide
The XLogP value of 3.1607 indicates that N-(2-carbamoylphenyl)-5-nitro-1-benzothiophene-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.33 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-carbamoylphenyl)-5-nitro-1-benzothiophene-2-carboxamide. Following Lipinski's Rule of Five, N-(2-carbamoylphenyl)-5-nitro-1-benzothiophene-2-carboxamide has 2 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 N-(2-carbamoylphenyl)-5-nitro-1-benzothiophene-2-carboxamide?
The CAS number of N-(2-carbamoylphenyl)-5-nitro-1-benzothiophene-2-carboxamide is 690693-02-8.
What is the molecular formula of N-(2-carbamoylphenyl)-5-nitro-1-benzothiophene-2-carboxamide?
The molecular formula of N-(2-carbamoylphenyl)-5-nitro-1-benzothiophene-2-carboxamide is C16H11N3O4S.
What is the molecular weight of N-(2-carbamoylphenyl)-5-nitro-1-benzothiophene-2-carboxamide?
The molecular weight of N-(2-carbamoylphenyl)-5-nitro-1-benzothiophene-2-carboxamide is 341.05 g/mol.
Where can I buy N-(2-carbamoylphenyl)-5-nitro-1-benzothiophene-2-carboxamide?
You can request a quote for N-(2-carbamoylphenyl)-5-nitro-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-(2-carbamoylphenyl)-5-nitro-1-benzothiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-carbamoylphenyl)-5-nitro-1-benzothiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.