4-(methylsulfonyl)-N-(3-nitrophenyl)benzamide
TL;DR: 4-(methylsulfonyl)-N-(3-nitrophenyl)benzamide (CAS 896348-45-1) is a chemical compound with molecular formula C14H12N2O5S and molecular weight 320.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylsulfonyl-N-(3-nitrophenyl)benzamide
Also Known As: 4-methanesulfonyl-N-(3-nitrophenyl)benzamide, 4-(methylsulfonyl)-N-(3-nitrophenyl)benzamide, 4-methylsulfonyl-N-(3-nitrophenyl)benzamide, F2558-0201
| Molecular Formula | C14H12N2O5S |
|---|---|
| Molecular Weight | 320.05 g/mol |
| LogP | 2.2506 |
| Topological Polar Surface Area | 106.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 320.0467 |
| Heavy Atoms | 22 |
| Complexity | 828.56665 |
Chemical Identifiers
| CAS Number | 896348-45-1 |
|---|---|
| SMILES | CS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-] |
Product Overview
4-(methylsulfonyl)-N-(3-nitrophenyl)benzamide (CAS 896348-45-1), with molecular formula C14H12N2O5S and molecular weight 320.05 g/mol. IUPAC: 4-methylsulfonyl-N-(3-nitrophenyl)benzamide.
Chemical Property Profile of 4-(methylsulfonyl)-N-(3-nitrophenyl)benzamide
Property Insights of 4-(methylsulfonyl)-N-(3-nitrophenyl)benzamide
The XLogP value of 2.2506 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(methylsulfonyl)-N-(3-nitrophenyl)benzamide. The TPSA of 106.38 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(methylsulfonyl)-N-(3-nitrophenyl)benzamide. Following Lipinski's Rule of Five, 4-(methylsulfonyl)-N-(3-nitrophenyl)benzamide 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 4-(methylsulfonyl)-N-(3-nitrophenyl)benzamide?
The CAS number of 4-(methylsulfonyl)-N-(3-nitrophenyl)benzamide is 896348-45-1.
What is the molecular formula of 4-(methylsulfonyl)-N-(3-nitrophenyl)benzamide?
The molecular formula of 4-(methylsulfonyl)-N-(3-nitrophenyl)benzamide is C14H12N2O5S.
What is the molecular weight of 4-(methylsulfonyl)-N-(3-nitrophenyl)benzamide?
The molecular weight of 4-(methylsulfonyl)-N-(3-nitrophenyl)benzamide is 320.05 g/mol.
Where can I buy 4-(methylsulfonyl)-N-(3-nitrophenyl)benzamide?
You can request a quote for 4-(methylsulfonyl)-N-(3-nitrophenyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(methylsulfonyl)-N-(3-nitrophenyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(methylsulfonyl)-N-(3-nitrophenyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.