3-(propan-2-ylsulfanyl)-1H-1,2,4-triazol-5-amine
TL;DR: 3-(propan-2-ylsulfanyl)-1H-1,2,4-triazol-5-amine (CAS 51420-47-4) is a chemical compound with molecular formula C5H10N4S and molecular weight 158.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-propan-2-ylsulfanyl-1H-1,2,4-triazol-5-amine
Also Known As: 3-(propan-2-ylsulfanyl)-1H-1,2,4-triazol-5-amine, TOS-BB-1194, 3-(isopropylthio)-1H-1,2,4-triazol-5-amine, 3-propan-2-ylsulfanyl-1H-1,2,4-triazol-5-amine, J1.511.167D
| Molecular Formula | C5H10N4S |
|---|---|
| Molecular Weight | 158.06 g/mol |
| LogP | 0.8874 |
| Topological Polar Surface Area | 67.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 158.06262 |
| Heavy Atoms | 10 |
| Complexity | 207.1678 |
Chemical Identifiers
| CAS Number | 51420-47-4 |
|---|---|
| SMILES | CC(C)SC1=NNC(=N1)N |
Product Overview
3-(propan-2-ylsulfanyl)-1H-1,2,4-triazol-5-amine (CAS 51420-47-4), with molecular formula C5H10N4S and molecular weight 158.06 g/mol. IUPAC: 3-propan-2-ylsulfanyl-1H-1,2,4-triazol-5-amine.
Chemical Property Profile of 3-(propan-2-ylsulfanyl)-1H-1,2,4-triazol-5-amine
Property Insights of 3-(propan-2-ylsulfanyl)-1H-1,2,4-triazol-5-amine
The XLogP value of 0.8874 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(propan-2-ylsulfanyl)-1H-1,2,4-triazol-5-amine. The TPSA of 67.59 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(propan-2-ylsulfanyl)-1H-1,2,4-triazol-5-amine. Following Lipinski's Rule of Five, 3-(propan-2-ylsulfanyl)-1H-1,2,4-triazol-5-amine has 2 hydrogen bond donor(s) and 4 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 3-(propan-2-ylsulfanyl)-1H-1,2,4-triazol-5-amine?
The CAS number of 3-(propan-2-ylsulfanyl)-1H-1,2,4-triazol-5-amine is 51420-47-4.
What is the molecular formula of 3-(propan-2-ylsulfanyl)-1H-1,2,4-triazol-5-amine?
The molecular formula of 3-(propan-2-ylsulfanyl)-1H-1,2,4-triazol-5-amine is C5H10N4S.
What is the molecular weight of 3-(propan-2-ylsulfanyl)-1H-1,2,4-triazol-5-amine?
The molecular weight of 3-(propan-2-ylsulfanyl)-1H-1,2,4-triazol-5-amine is 158.06 g/mol.
Where can I buy 3-(propan-2-ylsulfanyl)-1H-1,2,4-triazol-5-amine?
You can request a quote for 3-(propan-2-ylsulfanyl)-1H-1,2,4-triazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(propan-2-ylsulfanyl)-1H-1,2,4-triazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-(propan-2-ylsulfanyl)-1H-1,2,4-triazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.