3-(Ethylthio)-5-(2-thienyl)-4H-1,2,4-triazol-4-amine
TL;DR: 3-(Ethylthio)-5-(2-thienyl)-4H-1,2,4-triazol-4-amine (CAS 118158-92-2) is a chemical compound with molecular formula C8H10N4S2 and molecular weight 226.03468 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-ethylsulfanyl-5-thiophen-2-yl-1,2,4-triazol-4-amine
Also Known As: 3-(ethylsulfanyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-4-amine, 3-(ethylthio)-5-(2-thienyl)-4H-1,2,4-triazol-4-amine, 3-(pyridin-2-yl)cyclopentanone, 0046AD, 3-(ethylthio)-5-(thiophen-2-yl)-4H-1,2,4-triazol-4-amine
Technical Specifications
| Molecular Formula | C8H10N4S2 |
| Molecular Weight | 226.03468 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 110.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 226.03468 Da |
| Heavy Atoms | 14 |
| Complexity | 192.0 |
| SMILES | CCSC1=NN=C(N1N)C2=CC=CS2 |
| InChIKey | UWTQTJQKRFIQDP-UHFFFAOYSA-N |
Chemical Property Profile of 3-(Ethylthio)-5-(2-thienyl)-4H-1,2,4-triazol-4-amine
Property Insights of 3-(Ethylthio)-5-(2-thienyl)-4H-1,2,4-triazol-4-amine
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Ethylthio)-5-(2-thienyl)-4H-1,2,4-triazol-4-amine. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Ethylthio)-5-(2-thienyl)-4H-1,2,4-triazol-4-amine. Following Lipinski's Rule of Five, 3-(Ethylthio)-5-(2-thienyl)-4H-1,2,4-triazol-4-amine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(Ethylthio)-5-(2-thienyl)-4H-1,2,4-triazol-4-amine?
The CAS number of 3-(Ethylthio)-5-(2-thienyl)-4H-1,2,4-triazol-4-amine is 118158-92-2.
What is the molecular formula of 3-(Ethylthio)-5-(2-thienyl)-4H-1,2,4-triazol-4-amine?
The molecular formula of 3-(Ethylthio)-5-(2-thienyl)-4H-1,2,4-triazol-4-amine is C8H10N4S2.
What is the molecular weight of 3-(Ethylthio)-5-(2-thienyl)-4H-1,2,4-triazol-4-amine?
The molecular weight of 3-(Ethylthio)-5-(2-thienyl)-4H-1,2,4-triazol-4-amine is 226.03468 g/mol.
Where can I buy 3-(Ethylthio)-5-(2-thienyl)-4H-1,2,4-triazol-4-amine?
You can request a quote for 3-(Ethylthio)-5-(2-thienyl)-4H-1,2,4-triazol-4-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(Ethylthio)-5-(2-thienyl)-4H-1,2,4-triazol-4-amine?
Yes, CoreyChem provides custom synthesis services for 3-(Ethylthio)-5-(2-thienyl)-4H-1,2,4-triazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.