N-isopropyl-2-nitrobenzenesulfonamide
TL;DR: N-isopropyl-2-nitrobenzenesulfonamide (CAS 23530-42-9) is a chemical compound with molecular formula C9H12N2O4S and molecular weight 244.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitro-N-propan-2-ylbenzenesulfonamide
Also Known As: N-isopropyl-2-nitrobenzenesulfonamide, N-Isopropyl-2-nitrobenzenesulphonamide, 2-nitro-N-propan-2-ylbenzenesulfonamide, Benzenesulfonamide, N-(1-methylethyl)-2-nitro-, N-isopropyl-2-nitro-benzenesulfonamide
| Molecular Formula | C9H12N2O4S |
|---|---|
| Molecular Weight | 244.05 g/mol |
| LogP | 1.2815 |
| Topological Polar Surface Area | 89.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 244.05177 |
| Heavy Atoms | 16 |
| Complexity | 495.98538 |
Chemical Identifiers
| CAS Number | 23530-42-9 |
|---|---|
| SMILES | CC(C)NS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-] |
Product Overview
N-isopropyl-2-nitrobenzenesulfonamide (CAS 23530-42-9), with molecular formula C9H12N2O4S and molecular weight 244.05 g/mol. IUPAC: 2-nitro-N-propan-2-ylbenzenesulfonamide.
Chemical Property Profile of N-isopropyl-2-nitrobenzenesulfonamide
Property Insights of N-isopropyl-2-nitrobenzenesulfonamide
The XLogP value of 1.2815 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-isopropyl-2-nitrobenzenesulfonamide. The TPSA of 89.31 Ų falls within the moderate polarity range, balancing permeability and solubility for N-isopropyl-2-nitrobenzenesulfonamide. Following Lipinski's Rule of Five, N-isopropyl-2-nitrobenzenesulfonamide has 1 hydrogen bond donor(s) and 4 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-isopropyl-2-nitrobenzenesulfonamide?
The CAS number of N-isopropyl-2-nitrobenzenesulfonamide is 23530-42-9.
What is the molecular formula of N-isopropyl-2-nitrobenzenesulfonamide?
The molecular formula of N-isopropyl-2-nitrobenzenesulfonamide is C9H12N2O4S.
What is the molecular weight of N-isopropyl-2-nitrobenzenesulfonamide?
The molecular weight of N-isopropyl-2-nitrobenzenesulfonamide is 244.05 g/mol.
Where can I buy N-isopropyl-2-nitrobenzenesulfonamide?
You can request a quote for N-isopropyl-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-isopropyl-2-nitrobenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-isopropyl-2-nitrobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.