N-(3-methylphenyl)-2-nitrobenzenesulfonamide
TL;DR: N-(3-methylphenyl)-2-nitrobenzenesulfonamide (CAS 63228-68-2) is a chemical compound with molecular formula C13H12N2O4S and molecular weight 292.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-methylphenyl)-2-nitrobenzenesulfonamide
Also Known As: N-(3-methylphenyl)-2-nitrobenzenesulfonamide, 2-Nitro-N-m-tolyl-benzenesulfonamide, BAS 00356563, (3-methylphenyl)[(2-nitrophenyl)sulfonyl]amine, N-(3-METHYLPHENYL)-2-NITROBENZENE-1-SULFONAMIDE
| Molecular Formula | C13H12N2O4S |
|---|---|
| Molecular Weight | 292.05 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 292.0518 |
| Heavy Atoms | 20 |
| Complexity | 440.0 |
Chemical Identifiers
| CAS Number | 63228-68-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-] |
| InChIKey | TXAYYLVKJPPOES-UHFFFAOYSA-N |
Product Overview
N-(3-methylphenyl)-2-nitrobenzenesulfonamide (CAS 63228-68-2), with molecular formula C13H12N2O4S and molecular weight 292.05 g/mol. IUPAC: N-(3-methylphenyl)-2-nitrobenzenesulfonamide.
Chemical Property Profile of N-(3-methylphenyl)-2-nitrobenzenesulfonamide
Property Insights of N-(3-methylphenyl)-2-nitrobenzenesulfonamide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-methylphenyl)-2-nitrobenzenesulfonamide. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-methylphenyl)-2-nitrobenzenesulfonamide. Following Lipinski's Rule of Five, N-(3-methylphenyl)-2-nitrobenzenesulfonamide 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 N-(3-methylphenyl)-2-nitrobenzenesulfonamide?
The CAS number of N-(3-methylphenyl)-2-nitrobenzenesulfonamide is 63228-68-2.
What is the molecular formula of N-(3-methylphenyl)-2-nitrobenzenesulfonamide?
The molecular formula of N-(3-methylphenyl)-2-nitrobenzenesulfonamide is C13H12N2O4S.
What is the molecular weight of N-(3-methylphenyl)-2-nitrobenzenesulfonamide?
The molecular weight of N-(3-methylphenyl)-2-nitrobenzenesulfonamide is 292.05 g/mol.
Where can I buy N-(3-methylphenyl)-2-nitrobenzenesulfonamide?
You can request a quote for N-(3-methylphenyl)-2-nitrobenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-methylphenyl)-2-nitrobenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-methylphenyl)-2-nitrobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.