![3-nitro-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide structure](/static/products/7026/702647-96-9.webp)
3-nitro-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide
TL;DR: 3-nitro-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide (CAS 702647-96-9) is a chemical compound with molecular formula C14H15N3O6S2 and molecular weight 385.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-nitro-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide
Also Known As: 3-nitro-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide, 4-[2-[(3-nitrophenyl)sulfonylamino]ethyl]benzenesulfonamide, 4-(2-{[(3-nitrophenyl)sulfonyl]amino}ethyl)benzenesulfonamide, N-[4-(AMINOSULFONYL)PHENETHYL]-3-NITRO-1-BENZENESULFONAMIDE
| Molecular Formula | C14H15N3O6S2 |
|---|---|
| Molecular Weight | 385.04 g/mol |
| LogP | 0.7632 |
| Topological Polar Surface Area | 149.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 385.04022 |
| Heavy Atoms | 25 |
| Complexity | 985.48206 |
Chemical Identifiers
| CAS Number | 702647-96-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)S(=O)(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N)[N+](=O)[O-] |
Product Overview
3-nitro-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide (CAS 702647-96-9), with molecular formula C14H15N3O6S2 and molecular weight 385.04 g/mol. IUPAC: 3-nitro-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide.
Chemical Property Profile of 3-nitro-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide
Property Insights of 3-nitro-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide
The XLogP value of 0.7632 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-nitro-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide. The TPSA of 149.47 Ų indicates high polarity, suggesting 3-nitro-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-nitro-N-[2-(4-sulfamoylphenyl)ethyl]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 3-nitro-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide?
The CAS number of 3-nitro-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide is 702647-96-9.
What is the molecular formula of 3-nitro-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide?
The molecular formula of 3-nitro-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide is C14H15N3O6S2.
What is the molecular weight of 3-nitro-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide?
The molecular weight of 3-nitro-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide is 385.04 g/mol.
Where can I buy 3-nitro-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide?
You can request a quote for 3-nitro-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-nitro-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 3-nitro-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.