1H-1,2,4-Triazol-3-amine, 5-(hexylthio)-
TL;DR: 1H-1,2,4-Triazol-3-amine, 5-(hexylthio)- (CAS 100599-71-1) is a chemical compound with molecular formula C8H16N4S and molecular weight 200.10957 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-hexylsulfanyl-1H-1,2,4-triazol-5-amine
Also Known As: 1H-1,2,4-Triazol-3-amine, 5-(hexylthio)-, 3-hexylsulfanyl-1H-1,2,4-triazol-5-amine, 3-(hexylsulfanyl)-1H-1,2,4-triazol-5-amine, 5-(hexylsulfanyl)-4H-1,2,4-triazol-3-amine, 5-hexylthio-4H-1,2,4-triazole-3-ylamine
Technical Specifications
| Molecular Formula | C8H16N4S |
| Molecular Weight | 200.10957 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 92.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 200.10957 Da |
| Heavy Atoms | 13 |
| Complexity | 133.0 |
| SMILES | CCCCCCSC1=NNC(=N1)N |
| InChIKey | VEDCPCDENSXQHG-UHFFFAOYSA-N |
Chemical Property Profile of 1H-1,2,4-Triazol-3-amine, 5-(hexylthio)-
Property Insights of 1H-1,2,4-Triazol-3-amine, 5-(hexylthio)-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-1,2,4-Triazol-3-amine, 5-(hexylthio)-. The TPSA of 92.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-1,2,4-Triazol-3-amine, 5-(hexylthio)-. Following Lipinski's Rule of Five, 1H-1,2,4-Triazol-3-amine, 5-(hexylthio)- 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
What is the CAS number of 1H-1,2,4-Triazol-3-amine, 5-(hexylthio)-?
The CAS number of 1H-1,2,4-Triazol-3-amine, 5-(hexylthio)- is 100599-71-1.
What is the molecular formula of 1H-1,2,4-Triazol-3-amine, 5-(hexylthio)-?
The molecular formula of 1H-1,2,4-Triazol-3-amine, 5-(hexylthio)- is C8H16N4S.
What is the molecular weight of 1H-1,2,4-Triazol-3-amine, 5-(hexylthio)-?
The molecular weight of 1H-1,2,4-Triazol-3-amine, 5-(hexylthio)- is 200.10957 g/mol.
Where can I buy 1H-1,2,4-Triazol-3-amine, 5-(hexylthio)-?
You can request a quote for 1H-1,2,4-Triazol-3-amine, 5-(hexylthio)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1H-1,2,4-Triazol-3-amine, 5-(hexylthio)-?
Yes, CoreyChem provides custom synthesis services for 1H-1,2,4-Triazol-3-amine, 5-(hexylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.