3-methyl-4-(4-methylphenyl)-5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-methyl-4-(4-methylphenyl)-5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
3-methyl-4-(4-methylphenyl)-5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V001-8673 |
| Compound Name: | 3-methyl-4-(4-methylphenyl)-5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole |
| Molecular Weight: | 363.4 |
| Molecular Formula: | C18 H16 F3 N3 S |
| Smiles: | Cc1ccc(cc1)n1c(C)nnc1SCc1ccccc1C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.5823 |
| logD: | 4.5823 |
| logSw: | -4.5664 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.7611 |
| InChI Key: | QRSUQKZVIVXUSM-UHFFFAOYSA-N |