3-(2-chlorophenyl)-4-phenyl-5-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(2-chlorophenyl)-4-phenyl-5-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
3-(2-chlorophenyl)-4-phenyl-5-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V011-6337 |
| Compound Name: | 3-(2-chlorophenyl)-4-phenyl-5-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole |
| Molecular Weight: | 445.89 |
| Molecular Formula: | C22 H15 Cl F3 N3 S |
| Salt: | not_available |
| Smiles: | C(c1ccc(cc1)C(F)(F)F)Sc1nnc(c2ccccc2[Cl])n1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.0949 |
| logD: | 6.0949 |
| logSw: | -6.2907 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.7125 |
| InChI Key: | IORGRYMJBGKRPN-UHFFFAOYSA-N |