3-(4-methoxyphenyl)-4-(2-methylphenyl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(4-methoxyphenyl)-4-(2-methylphenyl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
3-(4-methoxyphenyl)-4-(2-methylphenyl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V005-6752 |
| Compound Name: | 3-(4-methoxyphenyl)-4-(2-methylphenyl)-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole |
| Molecular Weight: | 455.5 |
| Molecular Formula: | C24 H20 F3 N3 O S |
| Smiles: | Cc1ccccc1n1c(c2ccc(cc2)OC)nnc1SCc1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 6.4878 |
| logD: | 6.4878 |
| logSw: | -5.9701 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.955 |
| InChI Key: | UBISZXKPALXSLU-UHFFFAOYSA-N |