5-chloro-N,N,2-trimethylbenzene-1-sulfonamide
TL;DR: 5-chloro-N,N,2-trimethylbenzene-1-sulfonamide (CAS 473476-99-2) 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.
5-chloro-N,N,2-trimethylbenzenesulfonamide
Also Known As: 5-Chloro-N,N,2-trimethylbenzene-1-sulfonamide, 5-chloro-N,N,2-trimethylbenzenesulfonamide, 5-chloro-N,N,2-trimethyl-benzenesulfonamide, 818-878-6, RefChem:534903
| Molecular Formula | C9H12ClNO2S |
|---|---|
| Molecular Weight | 233.03 g/mol |
| LogP | 1.89872 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 233.02773 |
| Heavy Atoms | 14 |
| Complexity | 440.1252 |
Chemical Identifiers
| CAS Number | 473476-99-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)Cl)S(=O)(=O)N(C)C |
Product Overview
5-chloro-N,N,2-trimethylbenzene-1-sulfonamide (CAS 473476-99-2), with molecular formula C9H12ClNO2S and molecular weight 233.03 g/mol. IUPAC: 5-chloro-N,N,2-trimethylbenzenesulfonamide.
Chemical Property Profile of 5-chloro-N,N,2-trimethylbenzene-1-sulfonamide
Property Insights of 5-chloro-N,N,2-trimethylbenzene-1-sulfonamide
The XLogP value of 1.89872 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-chloro-N,N,2-trimethylbenzene-1-sulfonamide. With a topological polar surface area (TPSA) of 37.38 Ų, 5-chloro-N,N,2-trimethylbenzene-1-sulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-chloro-N,N,2-trimethylbenzene-1-sulfonamide 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 5-chloro-N,N,2-trimethylbenzene-1-sulfonamide?
The CAS number of 5-chloro-N,N,2-trimethylbenzene-1-sulfonamide is 473476-99-2.
What is the molecular formula of 5-chloro-N,N,2-trimethylbenzene-1-sulfonamide?
The molecular formula of 5-chloro-N,N,2-trimethylbenzene-1-sulfonamide is C9H12ClNO2S.
What is the molecular weight of 5-chloro-N,N,2-trimethylbenzene-1-sulfonamide?
The molecular weight of 5-chloro-N,N,2-trimethylbenzene-1-sulfonamide is 233.03 g/mol.
Where can I buy 5-chloro-N,N,2-trimethylbenzene-1-sulfonamide?
You can request a quote for 5-chloro-N,N,2-trimethylbenzene-1-sulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-chloro-N,N,2-trimethylbenzene-1-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 5-chloro-N,N,2-trimethylbenzene-1-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.