4-(3,4-dichlorophenyl)-3-(furan-2-yl)-5-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
4-(3,4-dichlorophenyl)-3-(furan-2-yl)-5-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
4-(3,4-dichlorophenyl)-3-(furan-2-yl)-5-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V011-1300 |
| Compound Name: | 4-(3,4-dichlorophenyl)-3-(furan-2-yl)-5-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole |
| Molecular Weight: | 470.3 |
| Molecular Formula: | C20 H12 Cl2 F3 N3 O S |
| Salt: | not_available |
| Smiles: | C(c1ccc(cc1)C(F)(F)F)Sc1nnc(c2ccco2)n1c1ccc(c(c1)[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.2425 |
| logD: | 6.2425 |
| logSw: | -6.6005 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.291 |
| InChI Key: | CCEZRDHYXYWEKR-UHFFFAOYSA-N |