3-Chloro-1-hydroxypyridine-2-thione
TL;DR: 3-Chloro-1-hydroxypyridine-2-thione (CAS 53976-63-9) is a chemical compound with molecular formula C5H4ClNOS and molecular weight 160.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-1-hydroxypyridine-2-thione
Also Known As: 3-Chloro-2-pyridinethiol 1-oxide, 3-chloro-1-hydroxypyridine-2-thione, 3-chloro-2-mercaptopyridine-N-oxide
| Molecular Formula | C5H4ClNOS |
|---|---|
| Molecular Weight | 160.97 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 55.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 160.97021 |
| Heavy Atoms | 9 |
| Complexity | 199.0 |
Chemical Identifiers
| CAS Number | 53976-63-9 |
|---|---|
| SMILES | C1=CN(C(=S)C(=C1)Cl)O |
| InChIKey | LXIUSXRBWXNEFS-UHFFFAOYSA-N |
Product Overview
3-Chloro-1-hydroxypyridine-2-thione (CAS 53976-63-9), with molecular formula C5H4ClNOS and molecular weight 160.97 g/mol. IUPAC: 3-chloro-1-hydroxypyridine-2-thione.
Chemical Property Profile of 3-Chloro-1-hydroxypyridine-2-thione
Property Insights of 3-Chloro-1-hydroxypyridine-2-thione
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chloro-1-hydroxypyridine-2-thione. With a topological polar surface area (TPSA) of 55.6 Ų, 3-Chloro-1-hydroxypyridine-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-1-hydroxypyridine-2-thione has 1 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-Chloro-1-hydroxypyridine-2-thione?
The CAS number of 3-Chloro-1-hydroxypyridine-2-thione is 53976-63-9.
What is the molecular formula of 3-Chloro-1-hydroxypyridine-2-thione?
The molecular formula of 3-Chloro-1-hydroxypyridine-2-thione is C5H4ClNOS.
What is the molecular weight of 3-Chloro-1-hydroxypyridine-2-thione?
The molecular weight of 3-Chloro-1-hydroxypyridine-2-thione is 160.97 g/mol.
Where can I buy 3-Chloro-1-hydroxypyridine-2-thione?
You can request a quote for 3-Chloro-1-hydroxypyridine-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-1-hydroxypyridine-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-1-hydroxypyridine-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.