3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide
TL;DR: 3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide (CAS 2438-99-5) is a chemical compound with molecular formula C12H8Cl2N2O4S and molecular weight 345.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide
Also Known As: 3,4-Dichloro-4'-nitrobenzenesulfonanilide, 3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide, Benzenesulfonanilide,4-dichloro-4'-nitro-, Benzenesulfonanilide, 3,4-dichloro-4'-nitro-, Benzenesulfonamide,4-dichloro-N-(4-nitrophenyl)-
| Molecular Formula | C12H8Cl2N2O4S |
|---|---|
| Molecular Weight | 345.96 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 345.9582 |
| Heavy Atoms | 21 |
| Complexity | 469.0 |
Chemical Identifiers
| CAS Number | 2438-99-5 |
|---|---|
| SMILES | C1=CC(=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)Cl)Cl)[N+](=O)[O-] |
| InChIKey | HAYZJERLLURJEF-UHFFFAOYSA-N |
Product Overview
3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide (CAS 2438-99-5), with molecular formula C12H8Cl2N2O4S and molecular weight 345.96 g/mol. IUPAC: 3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide.
Chemical Property Profile of 3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide
Property Insights of 3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide
The XLogP value of 4.1 indicates that 3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide. Following Lipinski's Rule of Five, 3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide 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 3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide?
The CAS number of 3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide is 2438-99-5.
What is the molecular formula of 3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide?
The molecular formula of 3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide is C12H8Cl2N2O4S.
What is the molecular weight of 3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide?
The molecular weight of 3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide is 345.96 g/mol.
Where can I buy 3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide?
You can request a quote for 3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 3,4-dichloro-N-(4-nitrophenyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.