4-chloro-N-(2-chloro-1,1-dimethylethyl)benzenesulfonamide
TL;DR: 4-chloro-N-(2-chloro-1,1-dimethylethyl)benzenesulfonamide (CAS 2849-75-4) is a chemical compound with molecular formula C10H13Cl2NO2S and molecular weight 281.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-(1-chloro-2-methylpropan-2-yl)benzenesulfonamide
Also Known As: 4-chloro-N-(2-chloro-1,1-dimethylethyl)benzenesulfonamide, BAS 00793808, 4-chloro-N-(1-chloro-2-methylpropan-2-yl)benzenesulfonamide, 4-Chloro-N-(2-chloro-1,1-dimethyl-ethyl)-benzenesulfonamide
| Molecular Formula | C10H13Cl2NO2S |
|---|---|
| Molecular Weight | 281.00 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 54.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 281.0044 |
| Heavy Atoms | 16 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 2849-75-4 |
|---|---|
| SMILES | CC(C)(CCl)NS(=O)(=O)C1=CC=C(C=C1)Cl |
| InChIKey | QDNIDKNJQIEJEU-UHFFFAOYSA-N |
Product Overview
4-chloro-N-(2-chloro-1,1-dimethylethyl)benzenesulfonamide (CAS 2849-75-4), with molecular formula C10H13Cl2NO2S and molecular weight 281.00 g/mol. IUPAC: 4-chloro-N-(1-chloro-2-methylpropan-2-yl)benzenesulfonamide.
Chemical Property Profile of 4-chloro-N-(2-chloro-1,1-dimethylethyl)benzenesulfonamide
Property Insights of 4-chloro-N-(2-chloro-1,1-dimethylethyl)benzenesulfonamide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-N-(2-chloro-1,1-dimethylethyl)benzenesulfonamide. With a topological polar surface area (TPSA) of 54.6 Ų, 4-chloro-N-(2-chloro-1,1-dimethylethyl)benzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-chloro-N-(2-chloro-1,1-dimethylethyl)benzenesulfonamide has 1 hydrogen bond donor(s) and 3 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 4-chloro-N-(2-chloro-1,1-dimethylethyl)benzenesulfonamide?
The CAS number of 4-chloro-N-(2-chloro-1,1-dimethylethyl)benzenesulfonamide is 2849-75-4.
What is the molecular formula of 4-chloro-N-(2-chloro-1,1-dimethylethyl)benzenesulfonamide?
The molecular formula of 4-chloro-N-(2-chloro-1,1-dimethylethyl)benzenesulfonamide is C10H13Cl2NO2S.
What is the molecular weight of 4-chloro-N-(2-chloro-1,1-dimethylethyl)benzenesulfonamide?
The molecular weight of 4-chloro-N-(2-chloro-1,1-dimethylethyl)benzenesulfonamide is 281.00 g/mol.
Where can I buy 4-chloro-N-(2-chloro-1,1-dimethylethyl)benzenesulfonamide?
You can request a quote for 4-chloro-N-(2-chloro-1,1-dimethylethyl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-N-(2-chloro-1,1-dimethylethyl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-(2-chloro-1,1-dimethylethyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.