N-Methyl-3-nitro-N-phenylbenzenesulfonamide
TL;DR: N-Methyl-3-nitro-N-phenylbenzenesulfonamide (CAS 162155-18-2) 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-methyl-3-nitro-N-phenylbenzenesulfonamide
Also Known As: N-Methyl-3-nitro-N-phenylbenzenesulfonamide, starbld0007794, n-(3-nitrophenylsulfonyl)-n-methylaniline, N-Methyl-N-phenyl-3-nitrobenzenesulfonamide, N-Methyl-3-nitro-N-phenyl-benzenesulfonamide
| Molecular Formula | C13H12N2O4S |
|---|---|
| Molecular Weight | 292.05 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 91.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 292.0518 |
| Heavy Atoms | 20 |
| Complexity | 434.0 |
Chemical Identifiers
| CAS Number | 162155-18-2 |
|---|---|
| SMILES | CN(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-] |
| InChIKey | DBMIIFUNCPIMKI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Methyl-3-nitro-N-phenylbenzenesulfonamide (CAS 162155-18-2), with molecular formula C13H12N2O4S and molecular weight 292.05 g/mol. IUPAC: N-methyl-3-nitro-N-phenylbenzenesulfonamide.
Chemical Property Profile of N-Methyl-3-nitro-N-phenylbenzenesulfonamide
Property Insights of N-Methyl-3-nitro-N-phenylbenzenesulfonamide
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Methyl-3-nitro-N-phenylbenzenesulfonamide. The TPSA of 91.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Methyl-3-nitro-N-phenylbenzenesulfonamide. Following Lipinski's Rule of Five, N-Methyl-3-nitro-N-phenylbenzenesulfonamide has 0 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-Methyl-3-nitro-N-phenylbenzenesulfonamide?
The CAS number of N-Methyl-3-nitro-N-phenylbenzenesulfonamide is 162155-18-2.
What is the molecular formula of N-Methyl-3-nitro-N-phenylbenzenesulfonamide?
The molecular formula of N-Methyl-3-nitro-N-phenylbenzenesulfonamide is C13H12N2O4S.
What is the molecular weight of N-Methyl-3-nitro-N-phenylbenzenesulfonamide?
The molecular weight of N-Methyl-3-nitro-N-phenylbenzenesulfonamide is 292.05 g/mol.
Where can I buy N-Methyl-3-nitro-N-phenylbenzenesulfonamide?
You can request a quote for N-Methyl-3-nitro-N-phenylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methyl-3-nitro-N-phenylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-Methyl-3-nitro-N-phenylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.