3-(3,4-dichlorophenyl)-4-methyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(3,4-dichlorophenyl)-4-methyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
3-(3,4-dichlorophenyl)-4-methyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-6213 |
| Compound Name: | 3-(3,4-dichlorophenyl)-4-methyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole |
| Molecular Weight: | 418.27 |
| Molecular Formula: | C17 H12 Cl2 F3 N3 S |
| Smiles: | Cn1c(c2ccc(c(c2)[Cl])[Cl])nnc1SCc1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 5.856 |
| logD: | 5.856 |
| logSw: | -6.3116 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.0508 |
| InChI Key: | UOLGBZBKVHYFCN-UHFFFAOYSA-N |