N-(benzenesulfonyl)-N-(2-nitrophenyl)benzenesulfonamide
TL;DR: N-(benzenesulfonyl)-N-(2-nitrophenyl)benzenesulfonamide (CAS 6321-90-0) is a chemical compound with molecular formula C18H14N2O6S2 and molecular weight 418.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(benzenesulfonyl)-N-(2-nitrophenyl)benzenesulfonamide
Also Known As: N,N-Bis(phenylsulfonyl)-2-nitroaniline, N,N-bis-benzenesulfonyl-2-nitro-aniline, N-(benzenesulfonyl)-N-(2-nitrophenyl)benzenesulfonamide, J1.127.744F, n-(2-nitrophenyl)-n-(phenylsulfonyl)benzenesulfonamide
| Molecular Formula | C18H14N2O6S2 |
|---|---|
| Molecular Weight | 418.03 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 418.02933 |
| Heavy Atoms | 28 |
| Complexity | 690.0 |
Chemical Identifiers
| CAS Number | 6321-90-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)N(C2=CC=CC=C2[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3 |
| InChIKey | OCMWVYODQVCYPU-UHFFFAOYSA-N |
Product Overview
N-(benzenesulfonyl)-N-(2-nitrophenyl)benzenesulfonamide (CAS 6321-90-0), with molecular formula C18H14N2O6S2 and molecular weight 418.03 g/mol. IUPAC: N-(benzenesulfonyl)-N-(2-nitrophenyl)benzenesulfonamide.
Chemical Property Profile of N-(benzenesulfonyl)-N-(2-nitrophenyl)benzenesulfonamide
Property Insights of N-(benzenesulfonyl)-N-(2-nitrophenyl)benzenesulfonamide
The XLogP value of 3.9 indicates that N-(benzenesulfonyl)-N-(2-nitrophenyl)benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(benzenesulfonyl)-N-(2-nitrophenyl)benzenesulfonamide. Following Lipinski's Rule of Five, N-(benzenesulfonyl)-N-(2-nitrophenyl)benzenesulfonamide has 0 hydrogen bond donor(s) and 7 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-(benzenesulfonyl)-N-(2-nitrophenyl)benzenesulfonamide?
The CAS number of N-(benzenesulfonyl)-N-(2-nitrophenyl)benzenesulfonamide is 6321-90-0.
What is the molecular formula of N-(benzenesulfonyl)-N-(2-nitrophenyl)benzenesulfonamide?
The molecular formula of N-(benzenesulfonyl)-N-(2-nitrophenyl)benzenesulfonamide is C18H14N2O6S2.
What is the molecular weight of N-(benzenesulfonyl)-N-(2-nitrophenyl)benzenesulfonamide?
The molecular weight of N-(benzenesulfonyl)-N-(2-nitrophenyl)benzenesulfonamide is 418.03 g/mol.
Where can I buy N-(benzenesulfonyl)-N-(2-nitrophenyl)benzenesulfonamide?
You can request a quote for N-(benzenesulfonyl)-N-(2-nitrophenyl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(benzenesulfonyl)-N-(2-nitrophenyl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(benzenesulfonyl)-N-(2-nitrophenyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.