3-cyclohexyl-4-(4-methoxyphenyl)-5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-cyclohexyl-4-(4-methoxyphenyl)-5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
3-cyclohexyl-4-(4-methoxyphenyl)-5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V005-7523 |
| Compound Name: | 3-cyclohexyl-4-(4-methoxyphenyl)-5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole |
| Molecular Weight: | 447.52 |
| Molecular Formula: | C23 H24 F3 N3 O S |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)n1c(C2CCCCC2)nnc1SCc1ccccc1C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 6.5022 |
| logD: | 6.5022 |
| logSw: | -5.7545 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.448 |
| InChI Key: | PJIOEVZTWGYQDI-UHFFFAOYSA-N |