4-Methyl-N-(3-nitrophenyl)benzenesulfonamide
TL;DR: 4-Methyl-N-(3-nitrophenyl)benzenesulfonamide (CAS 158204-26-3) is a chemical compound with molecular formula C13H12N2O4S and molecular weight 292.0518 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methyl-N-(3-nitrophenyl)benzenesulfonamide
Also Known As: m-Nitro-N-tosylaniline, CURIUM, 4-Methyl-N-(3-nitrophenyl)benzenesulfonamide, NCIOpen2_004838, 4-Methyl-N-(3-nitro-phenyl)-benzenesulfonamide
Technical Specifications
| Molecular Formula | C13H12N2O4S |
| Molecular Weight | 292.0518 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 292.0518 Da |
| Heavy Atoms | 20 |
| Complexity | 432.0 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC=C2)[N+](=O)[O-] |
| InChIKey | BRMWHPKATJJZBE-UHFFFAOYSA-N |
Chemical Property Profile of 4-Methyl-N-(3-nitrophenyl)benzenesulfonamide
Property Insights of 4-Methyl-N-(3-nitrophenyl)benzenesulfonamide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-N-(3-nitrophenyl)benzenesulfonamide. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methyl-N-(3-nitrophenyl)benzenesulfonamide. Following Lipinski's Rule of Five, 4-Methyl-N-(3-nitrophenyl)benzenesulfonamide 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
What is the CAS number of 4-Methyl-N-(3-nitrophenyl)benzenesulfonamide?
The CAS number of 4-Methyl-N-(3-nitrophenyl)benzenesulfonamide is 158204-26-3.
What is the molecular formula of 4-Methyl-N-(3-nitrophenyl)benzenesulfonamide?
The molecular formula of 4-Methyl-N-(3-nitrophenyl)benzenesulfonamide is C13H12N2O4S.
What is the molecular weight of 4-Methyl-N-(3-nitrophenyl)benzenesulfonamide?
The molecular weight of 4-Methyl-N-(3-nitrophenyl)benzenesulfonamide is 292.0518 g/mol.
Where can I buy 4-Methyl-N-(3-nitrophenyl)benzenesulfonamide?
You can request a quote for 4-Methyl-N-(3-nitrophenyl)benzenesulfonamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Methyl-N-(3-nitrophenyl)benzenesulfonamide?
Yes, CoreyChem provides custom synthesis services for 4-Methyl-N-(3-nitrophenyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.