1H-1,2,4-Triazole-3-thiol, 5-(4-pyridyl)-
TL;DR: 1H-1,2,4-Triazole-3-thiol, 5-(4-pyridyl)- (CAS 14910-06-6) is a chemical compound with molecular formula C7H6N4S and molecular weight 178.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-pyridin-4-yl-1,2-dihydro-1,2,4-triazole-3-thione
Also Known As: 5-(4-Pyridyl)-1H-1,2,4-triazole-3-thiol, 5-(pyridin-4-yl)-4H-1,2,4-triazole-3-thiol, 5-Pyridin-4-yl-4H-[1,2,4]triazole-3-thiol, Triazole-3-thione der., 5-(Pyridin-4-yl)-1h-1,2,4-triazole-3-thiol
| Molecular Formula | C7H6N4S |
|---|---|
| Molecular Weight | 178.03 g/mol |
| LogP | 1.52929 |
| Topological Polar Surface Area | 57.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 178.03131 |
| Heavy Atoms | 12 |
| Complexity | 416.22635 |
Chemical Identifiers
| CAS Number | 14910-06-6 |
|---|---|
| SMILES | C1=CN=CC=C1C2=NC(=S)NN2 |
Product Overview
1H-1,2,4-Triazole-3-thiol, 5-(4-pyridyl)- (CAS 14910-06-6), with molecular formula C7H6N4S and molecular weight 178.03 g/mol. IUPAC: 5-pyridin-4-yl-1,2-dihydro-1,2,4-triazole-3-thione.
Chemical Property Profile of 1H-1,2,4-Triazole-3-thiol, 5-(4-pyridyl)-
Property Insights of 1H-1,2,4-Triazole-3-thiol, 5-(4-pyridyl)-
The XLogP value of 1.52929 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-1,2,4-Triazole-3-thiol, 5-(4-pyridyl)-. With a topological polar surface area (TPSA) of 57.36 Ų, 1H-1,2,4-Triazole-3-thiol, 5-(4-pyridyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-1,2,4-Triazole-3-thiol, 5-(4-pyridyl)- has 2 hydrogen bond donor(s) and 3 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 1H-1,2,4-Triazole-3-thiol, 5-(4-pyridyl)-?
The CAS number of 1H-1,2,4-Triazole-3-thiol, 5-(4-pyridyl)- is 14910-06-6.
What is the molecular formula of 1H-1,2,4-Triazole-3-thiol, 5-(4-pyridyl)-?
The molecular formula of 1H-1,2,4-Triazole-3-thiol, 5-(4-pyridyl)- is C7H6N4S.
What is the molecular weight of 1H-1,2,4-Triazole-3-thiol, 5-(4-pyridyl)-?
The molecular weight of 1H-1,2,4-Triazole-3-thiol, 5-(4-pyridyl)- is 178.03 g/mol.
Where can I buy 1H-1,2,4-Triazole-3-thiol, 5-(4-pyridyl)-?
You can request a quote for 1H-1,2,4-Triazole-3-thiol, 5-(4-pyridyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-1,2,4-Triazole-3-thiol, 5-(4-pyridyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-1,2,4-Triazole-3-thiol, 5-(4-pyridyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.