4-(5-chloro-2-methylphenyl)-3-(furan-2-yl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
4-(5-chloro-2-methylphenyl)-3-(furan-2-yl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
4-(5-chloro-2-methylphenyl)-3-(furan-2-yl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V023-2604 |
| Compound Name: | 4-(5-chloro-2-methylphenyl)-3-(furan-2-yl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole |
| Molecular Weight: | 449.88 |
| Molecular Formula: | C21 H15 Cl F3 N3 O S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1n1c(c2ccco2)nnc1SCc1cccc(c1)C(F)(F)F)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.1535 |
| logD: | 6.1534 |
| logSw: | -6.3868 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.99 |
| InChI Key: | AKZYEEGCXDAWJI-UHFFFAOYSA-N |