s-(2-Chlorophenyl) 2-chlorobenzenesulfonothioate
TL;DR: s-(2-Chlorophenyl) 2-chlorobenzenesulfonothioate (CAS 29261-94-7) is a chemical compound with molecular formula C12H8Cl2O2S2 and molecular weight 317.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-2-(2-chlorophenyl)sulfonylsulfanylbenzene
Also Known As: s-(2-chlorophenyl) 2-chlorobenzenesulfonothioate, 1-chloro-2-(2-chlorophenyl)sulfonylsulfanylbenzene, S-(2-Chlorophenyl) 2-chlorobenzene-1-sulfonothioate, RefChem:379408
| Molecular Formula | C12H8Cl2O2S2 |
|---|---|
| Molecular Weight | 317.93 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 67.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 317.93427 |
| Heavy Atoms | 18 |
| Complexity | 367.0 |
Chemical Identifiers
| CAS Number | 29261-94-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)SS(=O)(=O)C2=CC=CC=C2Cl)Cl |
| InChIKey | DTKZESBALHGWMR-UHFFFAOYSA-N |
Product Overview
s-(2-Chlorophenyl) 2-chlorobenzenesulfonothioate (CAS 29261-94-7), with molecular formula C12H8Cl2O2S2 and molecular weight 317.93 g/mol. IUPAC: 1-chloro-2-(2-chlorophenyl)sulfonylsulfanylbenzene.
Chemical Property Profile of s-(2-Chlorophenyl) 2-chlorobenzenesulfonothioate
Property Insights of s-(2-Chlorophenyl) 2-chlorobenzenesulfonothioate
The XLogP value of 4.4 indicates that s-(2-Chlorophenyl) 2-chlorobenzenesulfonothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for s-(2-Chlorophenyl) 2-chlorobenzenesulfonothioate. Following Lipinski's Rule of Five, s-(2-Chlorophenyl) 2-chlorobenzenesulfonothioate has 0 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 s-(2-Chlorophenyl) 2-chlorobenzenesulfonothioate?
The CAS number of s-(2-Chlorophenyl) 2-chlorobenzenesulfonothioate is 29261-94-7.
What is the molecular formula of s-(2-Chlorophenyl) 2-chlorobenzenesulfonothioate?
The molecular formula of s-(2-Chlorophenyl) 2-chlorobenzenesulfonothioate is C12H8Cl2O2S2.
What is the molecular weight of s-(2-Chlorophenyl) 2-chlorobenzenesulfonothioate?
The molecular weight of s-(2-Chlorophenyl) 2-chlorobenzenesulfonothioate is 317.93 g/mol.
Where can I buy s-(2-Chlorophenyl) 2-chlorobenzenesulfonothioate?
You can request a quote for s-(2-Chlorophenyl) 2-chlorobenzenesulfonothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for s-(2-Chlorophenyl) 2-chlorobenzenesulfonothioate?
Yes, KEHONG BIO provides custom synthesis services for s-(2-Chlorophenyl) 2-chlorobenzenesulfonothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.