3-(chloromethyl)-N,N-dimethylbenzenesulfonamide
TL;DR: 3-(chloromethyl)-N,N-dimethylbenzenesulfonamide (CAS 743441-85-2) is a chemical compound with molecular formula C9H12ClNO2S and molecular weight 233.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(chloromethyl)-N,N-dimethylbenzenesulfonamide
Also Known As: 3-(chloromethyl)-N,N-dimethylbenzenesulfonamide, 3-(chloromethyl)-N,N-dimethylbenzene-1-sulfonamide, 3-Chloromethyl-N,N-dimethylbenzenesulfonamide, 3-(chloromethyl)-N,N-dimethyl-benzenesulfonamide
| Molecular Formula | C9H12ClNO2S |
|---|---|
| Molecular Weight | 233.03 g/mol |
| LogP | 1.6757 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.02773 |
| Heavy Atoms | 14 |
| Complexity | 414.57507 |
Chemical Identifiers
| CAS Number | 743441-85-2 |
|---|---|
| SMILES | CN(C)S(=O)(=O)C1=CC=CC(=C1)CCl |
Product Overview
3-(chloromethyl)-N,N-dimethylbenzenesulfonamide (CAS 743441-85-2), with molecular formula C9H12ClNO2S and molecular weight 233.03 g/mol. IUPAC: 3-(chloromethyl)-N,N-dimethylbenzenesulfonamide.
Chemical Property Profile of 3-(chloromethyl)-N,N-dimethylbenzenesulfonamide
Property Insights of 3-(chloromethyl)-N,N-dimethylbenzenesulfonamide
The XLogP value of 1.6757 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(chloromethyl)-N,N-dimethylbenzenesulfonamide. With a topological polar surface area (TPSA) of 37.38 Ų, 3-(chloromethyl)-N,N-dimethylbenzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(chloromethyl)-N,N-dimethylbenzenesulfonamide has 0 hydrogen bond donor(s) and 2 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-(chloromethyl)-N,N-dimethylbenzenesulfonamide?
The CAS number of 3-(chloromethyl)-N,N-dimethylbenzenesulfonamide is 743441-85-2.
What is the molecular formula of 3-(chloromethyl)-N,N-dimethylbenzenesulfonamide?
The molecular formula of 3-(chloromethyl)-N,N-dimethylbenzenesulfonamide is C9H12ClNO2S.
What is the molecular weight of 3-(chloromethyl)-N,N-dimethylbenzenesulfonamide?
The molecular weight of 3-(chloromethyl)-N,N-dimethylbenzenesulfonamide is 233.03 g/mol.
Where can I buy 3-(chloromethyl)-N,N-dimethylbenzenesulfonamide?
You can request a quote for 3-(chloromethyl)-N,N-dimethylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(chloromethyl)-N,N-dimethylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(chloromethyl)-N,N-dimethylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.