1-(2-Pyridyl)imidazole-2-thiol
TL;DR: 1-(2-Pyridyl)imidazole-2-thiol (CAS 114874-50-9) is a chemical compound with molecular formula C8H7N3S and molecular weight 177.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-pyridin-2-yl-1H-imidazole-2-thione
Also Known As: 1-(2-pyridyl)imidazole-2-thiol, 1-(2-pyridyl)-2-mercaptoimidazole, 1-pyridin-2-yl-1H-imidazole-2-thiol, 1-pyridin-2-yl-3H-imidazole-2-thione, 3-pyridin-2-yl-1H-imidazole-2-thione
| Molecular Formula | C8H7N3S |
|---|---|
| Molecular Weight | 177.04 g/mol |
| LogP | 1.92989 |
| Topological Polar Surface Area | 33.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 177.03607 |
| Heavy Atoms | 12 |
| Complexity | 415.12296 |
Chemical Identifiers
| CAS Number | 114874-50-9 |
|---|---|
| SMILES | C1=CC=NC(=C1)N2C=CNC2=S |
Product Overview
1-(2-Pyridyl)imidazole-2-thiol (CAS 114874-50-9), with molecular formula C8H7N3S and molecular weight 177.04 g/mol. IUPAC: 3-pyridin-2-yl-1H-imidazole-2-thione.
Chemical Property Profile of 1-(2-Pyridyl)imidazole-2-thiol
Property Insights of 1-(2-Pyridyl)imidazole-2-thiol
The XLogP value of 1.92989 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Pyridyl)imidazole-2-thiol. With a topological polar surface area (TPSA) of 33.61 Ų, 1-(2-Pyridyl)imidazole-2-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Pyridyl)imidazole-2-thiol 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 1-(2-Pyridyl)imidazole-2-thiol?
The CAS number of 1-(2-Pyridyl)imidazole-2-thiol is 114874-50-9.
What is the molecular formula of 1-(2-Pyridyl)imidazole-2-thiol?
The molecular formula of 1-(2-Pyridyl)imidazole-2-thiol is C8H7N3S.
What is the molecular weight of 1-(2-Pyridyl)imidazole-2-thiol?
The molecular weight of 1-(2-Pyridyl)imidazole-2-thiol is 177.04 g/mol.
Where can I buy 1-(2-Pyridyl)imidazole-2-thiol?
You can request a quote for 1-(2-Pyridyl)imidazole-2-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Pyridyl)imidazole-2-thiol?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Pyridyl)imidazole-2-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.