3-{[(2,4-dichlorophenyl)methyl]sulfanyl}-5-phenyl-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(2,4-dichlorophenyl)methyl]sulfanyl}-5-phenyl-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazole
3-{[(2,4-dichlorophenyl)methyl]sulfanyl}-5-phenyl-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V006-2023 |
| Compound Name: | 3-{[(2,4-dichlorophenyl)methyl]sulfanyl}-5-phenyl-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazole |
| Molecular Weight: | 480.34 |
| Molecular Formula: | C22 H14 Cl2 F3 N3 S |
| Salt: | not_available |
| Smiles: | C(c1ccc(cc1[Cl])[Cl])Sc1nnc(c2ccccc2)n1c1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 7.5187 |
| logD: | 7.5187 |
| logSw: | -6.8916 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.7125 |
| InChI Key: | UWVIHKWLZRSUEQ-UHFFFAOYSA-N |