3-ethylsulfonyl-N-(2-methoxy-4-nitrophenyl)benzamide
TL;DR: 3-ethylsulfonyl-N-(2-methoxy-4-nitrophenyl)benzamide (CAS 941998-90-9) is a chemical compound with molecular formula C16H16N2O6S and molecular weight 364.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethylsulfonyl-N-(2-methoxy-4-nitrophenyl)benzamide
Also Known As: 3-ethylsulfonyl-N-(2-methoxy-4-nitrophenyl)benzamide, F2647-0681, 3-(ethanesulfonyl)-N-(2-methoxy-4-nitrophenyl)benzamide, 3-(ethylsulfonyl)-N-(2-methoxy-4-nitrophenyl)benzamide, ethyl(oxo)-m-(N-2-methoxy-4-nitrophenylcarbamoyl)phenyl-lambda-sulfaniumolate
| Molecular Formula | C16H16N2O6S |
|---|---|
| Molecular Weight | 364.07 g/mol |
| LogP | 2.6493 |
| Topological Polar Surface Area | 115.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 364.0729 |
| Heavy Atoms | 25 |
| Complexity | 923.9722 |
Chemical Identifiers
| CAS Number | 941998-90-9 |
|---|---|
| SMILES | CCS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])OC |
Product Overview
3-ethylsulfonyl-N-(2-methoxy-4-nitrophenyl)benzamide (CAS 941998-90-9), with molecular formula C16H16N2O6S and molecular weight 364.07 g/mol. IUPAC: 3-ethylsulfonyl-N-(2-methoxy-4-nitrophenyl)benzamide.
Chemical Property Profile of 3-ethylsulfonyl-N-(2-methoxy-4-nitrophenyl)benzamide
Property Insights of 3-ethylsulfonyl-N-(2-methoxy-4-nitrophenyl)benzamide
The XLogP value of 2.6493 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-ethylsulfonyl-N-(2-methoxy-4-nitrophenyl)benzamide. The TPSA of 115.61 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-ethylsulfonyl-N-(2-methoxy-4-nitrophenyl)benzamide. Following Lipinski's Rule of Five, 3-ethylsulfonyl-N-(2-methoxy-4-nitrophenyl)benzamide has 1 hydrogen bond donor(s) and 6 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-ethylsulfonyl-N-(2-methoxy-4-nitrophenyl)benzamide?
The CAS number of 3-ethylsulfonyl-N-(2-methoxy-4-nitrophenyl)benzamide is 941998-90-9.
What is the molecular formula of 3-ethylsulfonyl-N-(2-methoxy-4-nitrophenyl)benzamide?
The molecular formula of 3-ethylsulfonyl-N-(2-methoxy-4-nitrophenyl)benzamide is C16H16N2O6S.
What is the molecular weight of 3-ethylsulfonyl-N-(2-methoxy-4-nitrophenyl)benzamide?
The molecular weight of 3-ethylsulfonyl-N-(2-methoxy-4-nitrophenyl)benzamide is 364.07 g/mol.
Where can I buy 3-ethylsulfonyl-N-(2-methoxy-4-nitrophenyl)benzamide?
You can request a quote for 3-ethylsulfonyl-N-(2-methoxy-4-nitrophenyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-ethylsulfonyl-N-(2-methoxy-4-nitrophenyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-ethylsulfonyl-N-(2-methoxy-4-nitrophenyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.