4-methyl-3-(pyridin-2-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione
TL;DR: 4-methyl-3-(pyridin-2-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione (CAS 34955-23-2) is a chemical compound with molecular formula C8H8N4S and molecular weight 192.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-3-pyridin-2-yl-1H-1,2,4-triazole-5-thione
Also Known As: 4-methyl-5-pyridin-2-yl-4H-1,2,4-triazole-3-thiol, 4-methyl-5-(pyridin-2-yl)-4H-1,2,4-triazole-3-thiol, 4-methyl-3-(pyridin-2-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione, 4-methyl-3-pyridin-2-yl-1H-1,2,4-triazole-5-thione, 4-Methyl-5-pyridin-2-yl-4H-[1,2,4]triazole-3-thiol
| Molecular Formula | C8H8N4S |
|---|---|
| Molecular Weight | 192.05 g/mol |
| LogP | 1.53969 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 192.04697 |
| Heavy Atoms | 13 |
| Complexity | 456.4963 |
Chemical Identifiers
| CAS Number | 34955-23-2 |
|---|---|
| SMILES | CN1C(=NNC1=S)C2=CC=CC=N2 |
Product Overview
4-methyl-3-(pyridin-2-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione (CAS 34955-23-2), with molecular formula C8H8N4S and molecular weight 192.05 g/mol. IUPAC: 4-methyl-3-pyridin-2-yl-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 4-methyl-3-(pyridin-2-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione
Property Insights of 4-methyl-3-(pyridin-2-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione
The XLogP value of 1.53969 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-methyl-3-(pyridin-2-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione. With a topological polar surface area (TPSA) of 46.5 Ų, 4-methyl-3-(pyridin-2-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-methyl-3-(pyridin-2-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione has 1 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 4-methyl-3-(pyridin-2-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione?
The CAS number of 4-methyl-3-(pyridin-2-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione is 34955-23-2.
What is the molecular formula of 4-methyl-3-(pyridin-2-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione?
The molecular formula of 4-methyl-3-(pyridin-2-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione is C8H8N4S.
What is the molecular weight of 4-methyl-3-(pyridin-2-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione?
The molecular weight of 4-methyl-3-(pyridin-2-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione is 192.05 g/mol.
Where can I buy 4-methyl-3-(pyridin-2-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione?
You can request a quote for 4-methyl-3-(pyridin-2-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methyl-3-(pyridin-2-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-3-(pyridin-2-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.