3-(Ethylsulfanyl)-5-phenyl-4h-1,2,4-triazol-4-ylamine
TL;DR: 3-(Ethylsulfanyl)-5-phenyl-4h-1,2,4-triazol-4-ylamine (CAS 121033-69-0) is a chemical compound with molecular formula C10H12N4S and molecular weight 220.07826 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-ethylsulfanyl-5-phenyl-1,2,4-triazol-4-amine
Also Known As: 3-(ethylsulfanyl)-5-phenyl-4h-1,2,4-triazol-4-ylamine, 3-ethylsulfanyl-5-phenyl-1,2,4-triazol-4-amine, 3-(ethylthio)-5-phenyl-4H-1,2,4-triazol-4-amine, 3-(ethylsulfanyl)-5-phenyl-4H-1,2,4-triazol-4-amine, AN-153/14987004
Technical Specifications
| Molecular Formula | C10H12N4S |
| Molecular Weight | 220.07826 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 82.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 220.07826 Da |
| Heavy Atoms | 15 |
| Complexity | 196.0 |
| SMILES | CCSC1=NN=C(N1N)C2=CC=CC=C2 |
| InChIKey | IALINWCFMALTFX-UHFFFAOYSA-N |
Chemical Property Profile of 3-(Ethylsulfanyl)-5-phenyl-4h-1,2,4-triazol-4-ylamine
Property Insights of 3-(Ethylsulfanyl)-5-phenyl-4h-1,2,4-triazol-4-ylamine
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Ethylsulfanyl)-5-phenyl-4h-1,2,4-triazol-4-ylamine. The TPSA of 82.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Ethylsulfanyl)-5-phenyl-4h-1,2,4-triazol-4-ylamine. Following Lipinski's Rule of Five, 3-(Ethylsulfanyl)-5-phenyl-4h-1,2,4-triazol-4-ylamine 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
What is the CAS number of 3-(Ethylsulfanyl)-5-phenyl-4h-1,2,4-triazol-4-ylamine?
The CAS number of 3-(Ethylsulfanyl)-5-phenyl-4h-1,2,4-triazol-4-ylamine is 121033-69-0.
What is the molecular formula of 3-(Ethylsulfanyl)-5-phenyl-4h-1,2,4-triazol-4-ylamine?
The molecular formula of 3-(Ethylsulfanyl)-5-phenyl-4h-1,2,4-triazol-4-ylamine is C10H12N4S.
What is the molecular weight of 3-(Ethylsulfanyl)-5-phenyl-4h-1,2,4-triazol-4-ylamine?
The molecular weight of 3-(Ethylsulfanyl)-5-phenyl-4h-1,2,4-triazol-4-ylamine is 220.07826 g/mol.
Where can I buy 3-(Ethylsulfanyl)-5-phenyl-4h-1,2,4-triazol-4-ylamine?
You can request a quote for 3-(Ethylsulfanyl)-5-phenyl-4h-1,2,4-triazol-4-ylamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(Ethylsulfanyl)-5-phenyl-4h-1,2,4-triazol-4-ylamine?
Yes, CoreyChem provides custom synthesis services for 3-(Ethylsulfanyl)-5-phenyl-4h-1,2,4-triazol-4-ylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.