![5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol structure](/static/products/1546/154641-09-5.webp)
5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol
TL;DR: 5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol (CAS 154641-09-5) is a chemical compound with molecular formula C5H8N4S and molecular weight 156.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6,7,8-tetrahydro-2H-[1,2,4]triazolo[4,3-a]pyrimidine-3-thione
Also Known As: 5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol, 2H,3H,5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrimidine-3-thione, 5,6,7,8-Tetrahydro-[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol, 2,5,6,7-tetrahydro-1H-[1,2,4]triazolo[4,3-a]pyrimidine-3-thione
| Molecular Formula | C5H8N4S |
|---|---|
| Molecular Weight | 156.05 g/mol |
| LogP | 0.75629 |
| Topological Polar Surface Area | 45.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 156.04697 |
| Heavy Atoms | 10 |
| Complexity | 286.08322 |
Chemical Identifiers
| CAS Number | 154641-09-5 |
|---|---|
| SMILES | C1CNC2=NNC(=S)N2C1 |
Product Overview
5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol (CAS 154641-09-5), with molecular formula C5H8N4S and molecular weight 156.05 g/mol. IUPAC: 5,6,7,8-tetrahydro-2H-[1,2,4]triazolo[4,3-a]pyrimidine-3-thione.
Chemical Property Profile of 5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol
Property Insights of 5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol
The XLogP value of 0.75629 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol. With a topological polar surface area (TPSA) of 45.64 Ų, 5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol 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 5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol?
The CAS number of 5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol is 154641-09-5.
What is the molecular formula of 5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol?
The molecular formula of 5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol is C5H8N4S.
What is the molecular weight of 5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol?
The molecular weight of 5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol is 156.05 g/mol.
Where can I buy 5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol?
You can request a quote for 5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol?
Yes, KEHONG BIO provides custom synthesis services for 5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.