4-cyclohexyl-3-(4-methoxyphenyl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
4-cyclohexyl-3-(4-methoxyphenyl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
4-cyclohexyl-3-(4-methoxyphenyl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V012-1676 |
| Compound Name: | 4-cyclohexyl-3-(4-methoxyphenyl)-5-({[3-(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)c1nnc(n1C1CCCCC1)SCc1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 6.4269 |
| logD: | 6.4269 |
| logSw: | -5.8301 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.089 |
| InChI Key: | ZRANXTSJFZOZNO-UHFFFAOYSA-N |