o-Nitrobenzenesulfenamide
TL;DR: o-Nitrobenzenesulfenamide (CAS 7257-59-2) is a chemical compound with molecular formula C6H6N2O2S and molecular weight 170.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-(2-nitrophenyl)thiohydroxylamine
Also Known As: S-(2-nitrophenyl)thiohydroxylamine, o-nitrobenzenesulfenamide, 2-nitrobenzenesulfenamide, 2-nitro-benzenesulfenamide, 1-(aminosulfanyl)-2-nitrobenzene
| Molecular Formula | C6H6N2O2S |
|---|---|
| Molecular Weight | 170.01 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 97.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 170.015 |
| Heavy Atoms | 11 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 7257-59-2 |
|---|---|
| SMILES | C1=CC=C(C(=C1)[N+](=O)[O-])SN |
| InChIKey | LOVVSIULYJABJF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
o-Nitrobenzenesulfenamide (CAS 7257-59-2), with molecular formula C6H6N2O2S and molecular weight 170.01 g/mol. IUPAC: S-(2-nitrophenyl)thiohydroxylamine.
Chemical Property Profile of o-Nitrobenzenesulfenamide
Property Insights of o-Nitrobenzenesulfenamide
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for o-Nitrobenzenesulfenamide. The TPSA of 97.1 Ų falls within the moderate polarity range, balancing permeability and solubility for o-Nitrobenzenesulfenamide. Following Lipinski's Rule of Five, o-Nitrobenzenesulfenamide 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 o-Nitrobenzenesulfenamide?
The CAS number of o-Nitrobenzenesulfenamide is 7257-59-2.
What is the molecular formula of o-Nitrobenzenesulfenamide?
The molecular formula of o-Nitrobenzenesulfenamide is C6H6N2O2S.
What is the molecular weight of o-Nitrobenzenesulfenamide?
The molecular weight of o-Nitrobenzenesulfenamide is 170.01 g/mol.
Where can I buy o-Nitrobenzenesulfenamide?
You can request a quote for o-Nitrobenzenesulfenamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for o-Nitrobenzenesulfenamide?
Yes, KEHONG BIO provides custom synthesis services for o-Nitrobenzenesulfenamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.