3-methyl-4-(2-methylphenyl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-methyl-4-(2-methylphenyl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
3-methyl-4-(2-methylphenyl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V008-0098 |
| Compound Name: | 3-methyl-4-(2-methylphenyl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole |
| Molecular Weight: | 363.4 |
| Molecular Formula: | C18 H16 F3 N3 S |
| Smiles: | Cc1ccccc1n1c(C)nnc1SCc1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.3565 |
| logD: | 4.3564 |
| logSw: | -4.4404 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.4601 |
| InChI Key: | DTRZEHIUFFMVFF-UHFFFAOYSA-N |