3-Mercaptopyridine
TL;DR: 3-Mercaptopyridine (CAS 16133-26-9) is a chemical compound with molecular formula C5H5NS and molecular weight 111.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pyridine-3-thiol
Also Known As: pyridine-3-thiol, 3-Mercaptopyridine, 3-PYRIDINETHIOL, 5-Mercaptopyridine, .3-Mercaptopyridine
| Molecular Formula | C5H5NS |
|---|---|
| Molecular Weight | 111.01 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 13.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 111.01427 |
| Heavy Atoms | 7 |
| Complexity | 56.0 |
Chemical Identifiers
| CAS Number | 16133-26-9 |
|---|---|
| SMILES | C1=CC(=CN=C1)S |
| InChIKey | FFWJHVGUAKWTKW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Mercaptopyridine (CAS 16133-26-9), with molecular formula C5H5NS and molecular weight 111.01 g/mol. IUPAC: pyridine-3-thiol.
Chemical Property Profile of 3-Mercaptopyridine
Property Insights of 3-Mercaptopyridine
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Mercaptopyridine. With a topological polar surface area (TPSA) of 13.9 Ų, 3-Mercaptopyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Mercaptopyridine 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-Mercaptopyridine?
The CAS number of 3-Mercaptopyridine is 16133-26-9.
What is the molecular formula of 3-Mercaptopyridine?
The molecular formula of 3-Mercaptopyridine is C5H5NS.
What is the molecular weight of 3-Mercaptopyridine?
The molecular weight of 3-Mercaptopyridine is 111.01 g/mol.
Where can I buy 3-Mercaptopyridine?
You can request a quote for 3-Mercaptopyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Mercaptopyridine?
Yes, KEHONG BIO provides custom synthesis services for 3-Mercaptopyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.