3-Chloro-N-(2-methoxy-4-nitrophenyl)-1-benzothiophene-2-carboxamide
TL;DR: 3-Chloro-N-(2-methoxy-4-nitrophenyl)-1-benzothiophene-2-carboxamide (CAS 304882-75-5) is a chemical compound with molecular formula C16H11ClN2O4S and molecular weight 362.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-(2-methoxy-4-nitrophenyl)-1-benzothiophene-2-carboxamide
Also Known As: BAS 00168826, 3-Chloro-N-(2-methoxy-4-nitrophenyl)-1-benzothiophene-2-carboxamide, F0359-0244, 3-chloro-N-(2-methoxy-4-nitrophenyl)benzo[b]thiophene-2-carboxamide, 3-Chloro-N-(2-methoxy-4-nitrophenyl)-2-thianaphthenecarboxamide
| Molecular Formula | C16H11ClN2O4S |
|---|---|
| Molecular Weight | 362.01 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.01282 |
| Heavy Atoms | 24 |
| Complexity | 489.0 |
Chemical Identifiers
| CAS Number | 304882-75-5 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2=C(C3=CC=CC=C3S2)Cl |
| InChIKey | JHWRWEPXMXSMLU-UHFFFAOYSA-N |
Product Overview
3-Chloro-N-(2-methoxy-4-nitrophenyl)-1-benzothiophene-2-carboxamide (CAS 304882-75-5), with molecular formula C16H11ClN2O4S and molecular weight 362.01 g/mol. IUPAC: 3-chloro-N-(2-methoxy-4-nitrophenyl)-1-benzothiophene-2-carboxamide.
Chemical Property Profile of 3-Chloro-N-(2-methoxy-4-nitrophenyl)-1-benzothiophene-2-carboxamide
Property Insights of 3-Chloro-N-(2-methoxy-4-nitrophenyl)-1-benzothiophene-2-carboxamide
The XLogP value of 4.5 indicates that 3-Chloro-N-(2-methoxy-4-nitrophenyl)-1-benzothiophene-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Chloro-N-(2-methoxy-4-nitrophenyl)-1-benzothiophene-2-carboxamide. Following Lipinski's Rule of Five, 3-Chloro-N-(2-methoxy-4-nitrophenyl)-1-benzothiophene-2-carboxamide has 1 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 3-Chloro-N-(2-methoxy-4-nitrophenyl)-1-benzothiophene-2-carboxamide?
The CAS number of 3-Chloro-N-(2-methoxy-4-nitrophenyl)-1-benzothiophene-2-carboxamide is 304882-75-5.
What is the molecular formula of 3-Chloro-N-(2-methoxy-4-nitrophenyl)-1-benzothiophene-2-carboxamide?
The molecular formula of 3-Chloro-N-(2-methoxy-4-nitrophenyl)-1-benzothiophene-2-carboxamide is C16H11ClN2O4S.
What is the molecular weight of 3-Chloro-N-(2-methoxy-4-nitrophenyl)-1-benzothiophene-2-carboxamide?
The molecular weight of 3-Chloro-N-(2-methoxy-4-nitrophenyl)-1-benzothiophene-2-carboxamide is 362.01 g/mol.
Where can I buy 3-Chloro-N-(2-methoxy-4-nitrophenyl)-1-benzothiophene-2-carboxamide?
You can request a quote for 3-Chloro-N-(2-methoxy-4-nitrophenyl)-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-(2-methoxy-4-nitrophenyl)-1-benzothiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-N-(2-methoxy-4-nitrophenyl)-1-benzothiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.