2-Chlorothiobenzamide
TL;DR: 2-Chlorothiobenzamide (CAS 15717-17-6) is a chemical compound with molecular formula C7H6ClNS and molecular weight 170.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chlorobenzenecarbothioamide
Also Known As: 2-Chlorothiobenzamide, 2-chlorobenzothioamide, 2-Chlorobenzenecarbothioamide, o-Chlorothiobenzamide, Benzenecarbothioamide, 2-chloro-
| Molecular Formula | C7H6ClNS |
|---|---|
| Molecular Weight | 170.99 g/mol |
| LogP | 1.9742 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 170.99095 |
| Heavy Atoms | 10 |
| Complexity | 259.53796 |
Chemical Identifiers
| CAS Number | 15717-17-6 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=S)N)Cl |
Product Overview
2-Chlorothiobenzamide (CAS 15717-17-6), with molecular formula C7H6ClNS and molecular weight 170.99 g/mol. IUPAC: 2-chlorobenzenecarbothioamide.
Chemical Property Profile of 2-Chlorothiobenzamide
Property Insights of 2-Chlorothiobenzamide
The XLogP value of 1.9742 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chlorothiobenzamide. With a topological polar surface area (TPSA) of 26.02 Ų, 2-Chlorothiobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chlorothiobenzamide has 1 hydrogen bond donor(s) and 1 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 2-Chlorothiobenzamide?
The CAS number of 2-Chlorothiobenzamide is 15717-17-6.
What is the molecular formula of 2-Chlorothiobenzamide?
The molecular formula of 2-Chlorothiobenzamide is C7H6ClNS.
What is the molecular weight of 2-Chlorothiobenzamide?
The molecular weight of 2-Chlorothiobenzamide is 170.99 g/mol.
Where can I buy 2-Chlorothiobenzamide?
You can request a quote for 2-Chlorothiobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chlorothiobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-Chlorothiobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.