3-phenyl-4-[3-(trifluoromethyl)phenyl]-5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-phenyl-4-[3-(trifluoromethyl)phenyl]-5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
3-phenyl-4-[3-(trifluoromethyl)phenyl]-5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V006-2001 |
| Compound Name: | 3-phenyl-4-[3-(trifluoromethyl)phenyl]-5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole |
| Molecular Weight: | 479.45 |
| Molecular Formula: | C23 H15 F6 N3 S |
| Salt: | not_available |
| Smiles: | C(c1ccccc1C(F)(F)F)Sc1nnc(c2ccccc2)n1c1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 7.0287 |
| logD: | 7.0286 |
| logSw: | -6.683 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.7125 |
| InChI Key: | LKWSCSQLEFVMLY-UHFFFAOYSA-N |