3-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine
TL;DR: 3-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine (CAS 869941-58-2) is a chemical compound with molecular formula C4H8N4S and molecular weight 144.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethylsulfanyl-1,2,4-triazol-4-amine
Also Known As: 3-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine, 3-Ethylsulfanyl-[1,2,4]triazol-4-ylamine, 3-ethylsulfanyl-1,2,4-triazol-4-amine, 3-ethylthio-1,2,4-triazole-4-ylamine, 3-(Ethylthio)-4H-1,2,4-triazol-4-amine
| Molecular Formula | C4H8N4S |
|---|---|
| Molecular Weight | 144.05 g/mol |
| LogP | 0.1039 |
| Topological Polar Surface Area | 56.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 144.04697 |
| Heavy Atoms | 9 |
| Complexity | 184.44824 |
Chemical Identifiers
| CAS Number | 869941-58-2 |
|---|---|
| SMILES | CCSC1=NN=CN1N |
Product Overview
3-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine (CAS 869941-58-2), with molecular formula C4H8N4S and molecular weight 144.05 g/mol. IUPAC: 3-ethylsulfanyl-1,2,4-triazol-4-amine.
Chemical Property Profile of 3-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine
Property Insights of 3-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine
The XLogP value of 0.1039 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine. With a topological polar surface area (TPSA) of 56.73 Ų, 3-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine has 1 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-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine?
The CAS number of 3-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine is 869941-58-2.
What is the molecular formula of 3-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine?
The molecular formula of 3-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine is C4H8N4S.
What is the molecular weight of 3-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine?
The molecular weight of 3-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine is 144.05 g/mol.
Where can I buy 3-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine?
You can request a quote for 3-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.