4-amino-N-(4-nitrophenyl)benzenesulfonamide
TL;DR: 4-amino-N-(4-nitrophenyl)benzenesulfonamide (CAS 6829-82-9) is a chemical compound with molecular formula C12H11N3O4S and molecular weight 293.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-N-(4-nitrophenyl)benzenesulfonamide
Also Known As: 4-amino-N-(4-nitrophenyl)benzenesulfonamide, Benzenesulfonamide, 4-amino-N-(4-nitrophenyl)-, 4-amino-N-(4-nitrophenyl)benzene-1-sulfonamide, N-(4-Nitrophenyl)-4-aminobenzenesulfonamide, J1.582.846C
| Molecular Formula | C12H11N3O4S |
|---|---|
| Molecular Weight | 293.05 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 293.04703 |
| Heavy Atoms | 20 |
| Complexity | 427.0 |
Chemical Identifiers
| CAS Number | 6829-82-9 |
|---|---|
| SMILES | C1=CC(=CC=C1N)S(=O)(=O)NC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | ACJNABKXDUDYAM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-amino-N-(4-nitrophenyl)benzenesulfonamide (CAS 6829-82-9), with molecular formula C12H11N3O4S and molecular weight 293.05 g/mol. IUPAC: 4-amino-N-(4-nitrophenyl)benzenesulfonamide.
Chemical Property Profile of 4-amino-N-(4-nitrophenyl)benzenesulfonamide
Property Insights of 4-amino-N-(4-nitrophenyl)benzenesulfonamide
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-amino-N-(4-nitrophenyl)benzenesulfonamide. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-amino-N-(4-nitrophenyl)benzenesulfonamide. Following Lipinski's Rule of Five, 4-amino-N-(4-nitrophenyl)benzenesulfonamide has 2 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 4-amino-N-(4-nitrophenyl)benzenesulfonamide?
The CAS number of 4-amino-N-(4-nitrophenyl)benzenesulfonamide is 6829-82-9.
What is the molecular formula of 4-amino-N-(4-nitrophenyl)benzenesulfonamide?
The molecular formula of 4-amino-N-(4-nitrophenyl)benzenesulfonamide is C12H11N3O4S.
What is the molecular weight of 4-amino-N-(4-nitrophenyl)benzenesulfonamide?
The molecular weight of 4-amino-N-(4-nitrophenyl)benzenesulfonamide is 293.05 g/mol.
Where can I buy 4-amino-N-(4-nitrophenyl)benzenesulfonamide?
You can request a quote for 4-amino-N-(4-nitrophenyl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-amino-N-(4-nitrophenyl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-amino-N-(4-nitrophenyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.