N-diazo-3-nitro-benzenesulfonamide
TL;DR: N-diazo-3-nitro-benzenesulfonamide (CAS 6647-85-4) is a chemical compound with molecular formula C6H4N4O4S and molecular weight 228.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-diazo-3-nitrobenzenesulfonamide
Also Known As: 3-nitrobenzenesulfonyl azide, (m-Nitrophenylsulfonyl) azide, m-nitrobenzenesulfonyl azide, NCIOpen2_005898, 3-nitrobenzene-1-sulfonyl azide
| Molecular Formula | C6H4N4O4S |
|---|---|
| Molecular Weight | 228.00 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 227.99533 |
| Heavy Atoms | 15 |
| Complexity | 388.0 |
Chemical Identifiers
| CAS Number | 6647-85-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)S(=O)(=O)N=[N+]=[N-])[N+](=O)[O-] |
| InChIKey | WGTKCHUGTQBBMR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-diazo-3-nitro-benzenesulfonamide (CAS 6647-85-4), with molecular formula C6H4N4O4S and molecular weight 228.00 g/mol. IUPAC: N-diazo-3-nitrobenzenesulfonamide.
Chemical Property Profile of N-diazo-3-nitro-benzenesulfonamide
Property Insights of N-diazo-3-nitro-benzenesulfonamide
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-diazo-3-nitro-benzenesulfonamide. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-diazo-3-nitro-benzenesulfonamide. Following Lipinski's Rule of Five, N-diazo-3-nitro-benzenesulfonamide has 0 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 N-diazo-3-nitro-benzenesulfonamide?
The CAS number of N-diazo-3-nitro-benzenesulfonamide is 6647-85-4.
What is the molecular formula of N-diazo-3-nitro-benzenesulfonamide?
The molecular formula of N-diazo-3-nitro-benzenesulfonamide is C6H4N4O4S.
What is the molecular weight of N-diazo-3-nitro-benzenesulfonamide?
The molecular weight of N-diazo-3-nitro-benzenesulfonamide is 228.00 g/mol.
Where can I buy N-diazo-3-nitro-benzenesulfonamide?
You can request a quote for N-diazo-3-nitro-benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-diazo-3-nitro-benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-diazo-3-nitro-benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.