n-(3-Chloro-2-methyl-4-nitrophenyl)benzenesulfonamide
TL;DR: n-(3-Chloro-2-methyl-4-nitrophenyl)benzenesulfonamide (CAS 86356-70-9) is a chemical compound with molecular formula C13H11ClN2O4S and molecular weight 326.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-2-methyl-4-nitrophenyl)benzenesulfonamide
Also Known As: NCIOpen2_007701, n-(3-chloro-2-methyl-4-nitrophenyl)benzenesulfonamide, N-(3-chloranyl-2-methyl-4-nitro-phenyl)benzenesulfonamide, N-(3-CHLORO-2-METHYL-4-NITRO-PHENYL)BENZENESULFONAMIDE, (1,1'-Biphenyl)-4,4'-bis(diazonium), 3,3'-dichloro-, labeled with carbon-14, bis(tetrafluoroborate(1-))
| Molecular Formula | C13H11ClN2O4S |
|---|---|
| Molecular Weight | 326.01 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 326.01282 |
| Heavy Atoms | 21 |
| Complexity | 468.0 |
Chemical Identifiers
| CAS Number | 86356-70-9 |
|---|---|
| SMILES | CC1=C(C=CC(=C1Cl)[N+](=O)[O-])NS(=O)(=O)C2=CC=CC=C2 |
| InChIKey | GPZVOIQOWJGZNX-UHFFFAOYSA-N |
Product Overview
n-(3-Chloro-2-methyl-4-nitrophenyl)benzenesulfonamide (CAS 86356-70-9), with molecular formula C13H11ClN2O4S and molecular weight 326.01 g/mol. IUPAC: N-(3-chloro-2-methyl-4-nitrophenyl)benzenesulfonamide.
Chemical Property Profile of n-(3-Chloro-2-methyl-4-nitrophenyl)benzenesulfonamide
Property Insights of n-(3-Chloro-2-methyl-4-nitrophenyl)benzenesulfonamide
The XLogP value of 3.3 indicates that n-(3-Chloro-2-methyl-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 n-(3-Chloro-2-methyl-4-nitrophenyl)benzenesulfonamide. Following Lipinski's Rule of Five, n-(3-Chloro-2-methyl-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 n-(3-Chloro-2-methyl-4-nitrophenyl)benzenesulfonamide?
The CAS number of n-(3-Chloro-2-methyl-4-nitrophenyl)benzenesulfonamide is 86356-70-9.
What is the molecular formula of n-(3-Chloro-2-methyl-4-nitrophenyl)benzenesulfonamide?
The molecular formula of n-(3-Chloro-2-methyl-4-nitrophenyl)benzenesulfonamide is C13H11ClN2O4S.
What is the molecular weight of n-(3-Chloro-2-methyl-4-nitrophenyl)benzenesulfonamide?
The molecular weight of n-(3-Chloro-2-methyl-4-nitrophenyl)benzenesulfonamide is 326.01 g/mol.
Where can I buy n-(3-Chloro-2-methyl-4-nitrophenyl)benzenesulfonamide?
You can request a quote for n-(3-Chloro-2-methyl-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 n-(3-Chloro-2-methyl-4-nitrophenyl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for n-(3-Chloro-2-methyl-4-nitrophenyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.