N-tert-butyl-2-nitrobenzenesulfonamide
TL;DR: N-tert-butyl-2-nitrobenzenesulfonamide (CAS 363587-67-1) is a chemical compound with molecular formula C10H14N2O4S and molecular weight 258.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-tert-butyl-2-nitrobenzenesulfonamide
Also Known As: N-tert-butyl-2-nitrobenzenesulfonamide, N-(tert-Butyl)-2-nitrobenzenesulfonamide, N-tert-butyl-2-nitrobenzene-1-sulfonamide, N-tert-butyl-2-nitro-benzenesulfonamide, (tert-butyl)[(2-nitrophenyl)sulfonyl]amine
| Molecular Formula | C10H14N2O4S |
|---|---|
| Molecular Weight | 258.07 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.0674 |
| Heavy Atoms | 17 |
| Complexity | 375.0 |
Chemical Identifiers
| CAS Number | 363587-67-1 |
|---|---|
| SMILES | CC(C)(C)NS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-] |
| InChIKey | OZVQKJSICMYVSR-UHFFFAOYSA-N |
Product Overview
N-tert-butyl-2-nitrobenzenesulfonamide (CAS 363587-67-1), with molecular formula C10H14N2O4S and molecular weight 258.07 g/mol. IUPAC: N-tert-butyl-2-nitrobenzenesulfonamide.
Chemical Property Profile of N-tert-butyl-2-nitrobenzenesulfonamide
Property Insights of N-tert-butyl-2-nitrobenzenesulfonamide
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-tert-butyl-2-nitrobenzenesulfonamide. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-tert-butyl-2-nitrobenzenesulfonamide. Following Lipinski's Rule of Five, N-tert-butyl-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-tert-butyl-2-nitrobenzenesulfonamide?
The CAS number of N-tert-butyl-2-nitrobenzenesulfonamide is 363587-67-1.
What is the molecular formula of N-tert-butyl-2-nitrobenzenesulfonamide?
The molecular formula of N-tert-butyl-2-nitrobenzenesulfonamide is C10H14N2O4S.
What is the molecular weight of N-tert-butyl-2-nitrobenzenesulfonamide?
The molecular weight of N-tert-butyl-2-nitrobenzenesulfonamide is 258.07 g/mol.
Where can I buy N-tert-butyl-2-nitrobenzenesulfonamide?
You can request a quote for N-tert-butyl-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-tert-butyl-2-nitrobenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-tert-butyl-2-nitrobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.