![1H-1,2,4-Triazole, 3-[[[4-(trifluoromethyl)phenyl]methyl]thio]- structure](/static/products/1238/123856-95-1.webp)
1H-1,2,4-Triazole, 3-[[[4-(trifluoromethyl)phenyl]methyl]thio]-
TL;DR: 1H-1,2,4-Triazole, 3-[[[4-(trifluoromethyl)phenyl]methyl]thio]- (CAS 123856-95-1) is a chemical compound with molecular formula C10H8F3N3S and molecular weight 259.0391 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-1H-1,2,4-triazole
Also Known As: 1H-1,2,4-Triazole, 3-[[[4-(trifluoromethyl)phenyl]methyl]thio]-, 5-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-1H-1,2,4-triazole, 3-(4-Trifluoromethyl-benzylsulfanyl)-4H-[1,2,4]triazole, 3-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-4H-1,2,4-triazole, 5-({[4-(Trifluoromethyl)phenyl]methyl}sulfanyl)-1H-1,2,4-triazole
Technical Specifications
| Molecular Formula | C10H8F3N3S |
| Molecular Weight | 259.0391 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 66.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 259.0391 Da |
| Heavy Atoms | 17 |
| Complexity | 241.0 |
| SMILES | C1=CC(=CC=C1CSC2=NC=NN2)C(F)(F)F |
| InChIKey | GAVCBTAAETXETA-UHFFFAOYSA-N |
Chemical Property Profile of 1H-1,2,4-Triazole, 3-[[[4-(trifluoromethyl)phenyl]methyl]thio]-
Property Insights of 1H-1,2,4-Triazole, 3-[[[4-(trifluoromethyl)phenyl]methyl]thio]-
The XLogP value of 3.2 indicates that 1H-1,2,4-Triazole, 3-[[[4-(trifluoromethyl)phenyl]methyl]thio]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-1,2,4-Triazole, 3-[[[4-(trifluoromethyl)phenyl]methyl]thio]-. Following Lipinski's Rule of Five, 1H-1,2,4-Triazole, 3-[[[4-(trifluoromethyl)phenyl]methyl]thio]- has 1 hydrogen bond donor(s) and 6 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-Triazole, 3-[[[4-(trifluoromethyl)phenyl]methyl]thio]-?
The CAS number of 1H-1,2,4-Triazole, 3-[[[4-(trifluoromethyl)phenyl]methyl]thio]- is 123856-95-1.
What is the molecular formula of 1H-1,2,4-Triazole, 3-[[[4-(trifluoromethyl)phenyl]methyl]thio]-?
The molecular formula of 1H-1,2,4-Triazole, 3-[[[4-(trifluoromethyl)phenyl]methyl]thio]- is C10H8F3N3S.
What is the molecular weight of 1H-1,2,4-Triazole, 3-[[[4-(trifluoromethyl)phenyl]methyl]thio]-?
The molecular weight of 1H-1,2,4-Triazole, 3-[[[4-(trifluoromethyl)phenyl]methyl]thio]- is 259.0391 g/mol.
Where can I buy 1H-1,2,4-Triazole, 3-[[[4-(trifluoromethyl)phenyl]methyl]thio]-?
You can request a quote for 1H-1,2,4-Triazole, 3-[[[4-(trifluoromethyl)phenyl]methyl]thio]- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1H-1,2,4-Triazole, 3-[[[4-(trifluoromethyl)phenyl]methyl]thio]-?
Yes, CoreyChem provides custom synthesis services for 1H-1,2,4-Triazole, 3-[[[4-(trifluoromethyl)phenyl]methyl]thio]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.