5-Chloropyridine-2-thiol
TL;DR: 5-Chloropyridine-2-thiol (CAS 40771-41-3) is a chemical compound with molecular formula C5H4ClNS and molecular weight 144.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-1H-pyridine-2-thione
Also Known As: 5-chloropyridine-2-thiol, 5-chloro-2-pyridinethiol, 5-chloro-1H-pyridine-2-thione, 3-Chloro-6-mercaptopyridine, 5-Chloropyridine-2(1H)-thione
| Molecular Formula | C5H4ClNS |
|---|---|
| Molecular Weight | 144.98 g/mol |
| LogP | 2.39759 |
| Topological Polar Surface Area | 15.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 144.9753 |
| Heavy Atoms | 8 |
| Complexity | 209.62032 |
Chemical Identifiers
| CAS Number | 40771-41-3 |
|---|---|
| SMILES | C1=CC(=S)NC=C1Cl |
Product Overview
5-Chloropyridine-2-thiol (CAS 40771-41-3), with molecular formula C5H4ClNS and molecular weight 144.98 g/mol. IUPAC: 5-chloro-1H-pyridine-2-thione.
Chemical Property Profile of 5-Chloropyridine-2-thiol
Property Insights of 5-Chloropyridine-2-thiol
The XLogP value of 2.39759 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloropyridine-2-thiol. With a topological polar surface area (TPSA) of 15.79 Ų, 5-Chloropyridine-2-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloropyridine-2-thiol 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 5-Chloropyridine-2-thiol?
The CAS number of 5-Chloropyridine-2-thiol is 40771-41-3.
What is the molecular formula of 5-Chloropyridine-2-thiol?
The molecular formula of 5-Chloropyridine-2-thiol is C5H4ClNS.
What is the molecular weight of 5-Chloropyridine-2-thiol?
The molecular weight of 5-Chloropyridine-2-thiol is 144.98 g/mol.
Where can I buy 5-Chloropyridine-2-thiol?
You can request a quote for 5-Chloropyridine-2-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloropyridine-2-thiol?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloropyridine-2-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.