4-(3,4-dichlorophenyl)-3-(4-methoxyphenyl)-5-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
4-(3,4-dichlorophenyl)-3-(4-methoxyphenyl)-5-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
4-(3,4-dichlorophenyl)-3-(4-methoxyphenyl)-5-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V010-9483 |
| Compound Name: | 4-(3,4-dichlorophenyl)-3-(4-methoxyphenyl)-5-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole |
| Molecular Weight: | 510.36 |
| Molecular Formula: | C23 H16 Cl2 F3 N3 O S |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)c1nnc(n1c1ccc(c(c1)[Cl])[Cl])SCc1ccc(cc1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 7.2754 |
| logD: | 7.2754 |
| logSw: | -6.8115 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.256 |
| InChI Key: | UOOUGRHUOGTVIN-UHFFFAOYSA-N |