N-(3-chloro-4-fluorophenyl)-2-nitrobenzenesulfonamide
TL;DR: N-(3-chloro-4-fluorophenyl)-2-nitrobenzenesulfonamide (CAS 326901-80-8) is a chemical compound with molecular formula C12H8ClFN2O4S and molecular weight 329.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-fluorophenyl)-2-nitrobenzenesulfonamide
Also Known As: N-(3-chloro-4-fluorophenyl)-2-nitrobenzenesulfonamide, BAS 00627662, AB00088017-01, (3-chloro-4-fluorophenyl)[(2-nitrophenyl)sulfonyl]amine, N-(3-Chloro-4-fluoro-phenyl)-2-nitro-benzenesulfonamide
| Molecular Formula | C12H8ClFN2O4S |
|---|---|
| Molecular Weight | 329.99 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 329.98773 |
| Heavy Atoms | 21 |
| Complexity | 479.0 |
Chemical Identifiers
| CAS Number | 326901-80-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC(=C(C=C2)F)Cl |
| InChIKey | FAHVHGSTKKCAGY-UHFFFAOYSA-N |
Product Overview
N-(3-chloro-4-fluorophenyl)-2-nitrobenzenesulfonamide (CAS 326901-80-8), with molecular formula C12H8ClFN2O4S and molecular weight 329.99 g/mol. IUPAC: N-(3-chloro-4-fluorophenyl)-2-nitrobenzenesulfonamide.
Chemical Property Profile of N-(3-chloro-4-fluorophenyl)-2-nitrobenzenesulfonamide
Property Insights of N-(3-chloro-4-fluorophenyl)-2-nitrobenzenesulfonamide
The XLogP value of 3.0 indicates that N-(3-chloro-4-fluorophenyl)-2-nitrobenzenesulfonamide 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 N-(3-chloro-4-fluorophenyl)-2-nitrobenzenesulfonamide. Following Lipinski's Rule of Five, N-(3-chloro-4-fluorophenyl)-2-nitrobenzenesulfonamide has 1 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-(3-chloro-4-fluorophenyl)-2-nitrobenzenesulfonamide?
The CAS number of N-(3-chloro-4-fluorophenyl)-2-nitrobenzenesulfonamide is 326901-80-8.
What is the molecular formula of N-(3-chloro-4-fluorophenyl)-2-nitrobenzenesulfonamide?
The molecular formula of N-(3-chloro-4-fluorophenyl)-2-nitrobenzenesulfonamide is C12H8ClFN2O4S.
What is the molecular weight of N-(3-chloro-4-fluorophenyl)-2-nitrobenzenesulfonamide?
The molecular weight of N-(3-chloro-4-fluorophenyl)-2-nitrobenzenesulfonamide is 329.99 g/mol.
Where can I buy N-(3-chloro-4-fluorophenyl)-2-nitrobenzenesulfonamide?
You can request a quote for N-(3-chloro-4-fluorophenyl)-2-nitrobenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-chloro-4-fluorophenyl)-2-nitrobenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-chloro-4-fluorophenyl)-2-nitrobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.