4-amino-4H-1,2,4-triazole-3,5-dithiol
TL;DR: 4-amino-4H-1,2,4-triazole-3,5-dithiol (CAS 3652-33-3) is a chemical compound with molecular formula C2H4N4S2 and molecular weight 147.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-1,2,4-triazolidine-3,5-dithione
Also Known As: 4-amino-4H-1,2,4-triazole-3,5-dithiol, 4-amino-1,2,4-triazolidine-3,5-dithione, 4-amino-1,2,4-triazole-3,5-dithiol, 4-amino-3,5-dimercapto-1,2,4-triazole, 4H-1,2,4-triazole-3,5-dithiol, 4-amino-
| Molecular Formula | C2H4N4S2 |
|---|---|
| Molecular Weight | 147.99 g/mol |
| LogP | 0.31708 |
| Topological Polar Surface Area | 62.53 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 147.98773 |
| Heavy Atoms | 8 |
| Complexity | 249.21869 |
Chemical Identifiers
| CAS Number | 3652-33-3 |
|---|---|
| SMILES | C1(=S)NNC(=S)N1N |
Product Overview
4-amino-4H-1,2,4-triazole-3,5-dithiol (CAS 3652-33-3), with molecular formula C2H4N4S2 and molecular weight 147.99 g/mol. IUPAC: 4-amino-1,2,4-triazolidine-3,5-dithione.
Chemical Property Profile of 4-amino-4H-1,2,4-triazole-3,5-dithiol
Property Insights of 4-amino-4H-1,2,4-triazole-3,5-dithiol
The XLogP value of 0.31708 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-amino-4H-1,2,4-triazole-3,5-dithiol. The TPSA of 62.53 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-amino-4H-1,2,4-triazole-3,5-dithiol. Following Lipinski's Rule of Five, 4-amino-4H-1,2,4-triazole-3,5-dithiol has 3 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-amino-4H-1,2,4-triazole-3,5-dithiol?
The CAS number of 4-amino-4H-1,2,4-triazole-3,5-dithiol is 3652-33-3.
What is the molecular formula of 4-amino-4H-1,2,4-triazole-3,5-dithiol?
The molecular formula of 4-amino-4H-1,2,4-triazole-3,5-dithiol is C2H4N4S2.
What is the molecular weight of 4-amino-4H-1,2,4-triazole-3,5-dithiol?
The molecular weight of 4-amino-4H-1,2,4-triazole-3,5-dithiol is 147.99 g/mol.
Where can I buy 4-amino-4H-1,2,4-triazole-3,5-dithiol?
You can request a quote for 4-amino-4H-1,2,4-triazole-3,5-dithiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-amino-4H-1,2,4-triazole-3,5-dithiol?
Yes, KEHONG BIO provides custom synthesis services for 4-amino-4H-1,2,4-triazole-3,5-dithiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.