Imidazole-2-thiol, 1-(2-pyridyl)-, dihydrochloride
TL;DR: Imidazole-2-thiol, 1-(2-pyridyl)-, dihydrochloride (CAS 64038-66-0) is a chemical compound with molecular formula C8H9Cl2N3S and molecular weight 248.99 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;dihydrochloride
Also Known As: Imidazole-2-thiol, 1-(2-pyridyl)-, dihydrochloride, 1-(2'-Pyridyl)-2-mercaptoimidazole dihydrochloride, Imidazole, 1-(2'-pyridyl)-2-mercapto-, dihydrochloride, 3-pyridin-2-yl-1H-imidazole-2-thione dihydrochloride, 3-pyridin-2-yl-1H-imidazole-2-thione,dihydrochloride
| Molecular Formula | C8H9Cl2N3S |
|---|---|
| Molecular Weight | 248.99 g/mol |
| LogP | 2.77349 |
| Topological Polar Surface Area | 33.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 248.98943 |
| Heavy Atoms | 14 |
| Complexity | 423.40637 |
Chemical Identifiers
| CAS Number | 64038-66-0 |
|---|---|
| SMILES | C1=CC=NC(=C1)N2C=CNC2=S.Cl.Cl |
Product Overview
Imidazole-2-thiol, 1-(2-pyridyl)-, dihydrochloride (CAS 64038-66-0), with molecular formula C8H9Cl2N3S and molecular weight 248.99 g/mol. IUPAC: 3-pyridin-2-yl-1H-imidazole-2-thione;dihydrochloride.
Chemical Property Profile of Imidazole-2-thiol, 1-(2-pyridyl)-, dihydrochloride
Property Insights of Imidazole-2-thiol, 1-(2-pyridyl)-, dihydrochloride
The XLogP value of 2.77349 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Imidazole-2-thiol, 1-(2-pyridyl)-, dihydrochloride. With a topological polar surface area (TPSA) of 33.61 Ų, Imidazole-2-thiol, 1-(2-pyridyl)-, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Imidazole-2-thiol, 1-(2-pyridyl)-, dihydrochloride 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 Imidazole-2-thiol, 1-(2-pyridyl)-, dihydrochloride?
The CAS number of Imidazole-2-thiol, 1-(2-pyridyl)-, dihydrochloride is 64038-66-0.
What is the molecular formula of Imidazole-2-thiol, 1-(2-pyridyl)-, dihydrochloride?
The molecular formula of Imidazole-2-thiol, 1-(2-pyridyl)-, dihydrochloride is C8H9Cl2N3S.
What is the molecular weight of Imidazole-2-thiol, 1-(2-pyridyl)-, dihydrochloride?
The molecular weight of Imidazole-2-thiol, 1-(2-pyridyl)-, dihydrochloride is 248.99 g/mol.
Where can I buy Imidazole-2-thiol, 1-(2-pyridyl)-, dihydrochloride?
You can request a quote for Imidazole-2-thiol, 1-(2-pyridyl)-, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Imidazole-2-thiol, 1-(2-pyridyl)-, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Imidazole-2-thiol, 1-(2-pyridyl)-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.