3-(furan-2-yl)-4-(2-methylphenyl)-5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(furan-2-yl)-4-(2-methylphenyl)-5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
3-(furan-2-yl)-4-(2-methylphenyl)-5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V004-6764 |
| Compound Name: | 3-(furan-2-yl)-4-(2-methylphenyl)-5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole |
| Molecular Weight: | 415.44 |
| Molecular Formula: | C21 H16 F3 N3 O S |
| Salt: | not_available |
| Smiles: | Cc1ccccc1n1c(c2ccco2)nnc1SCc1ccccc1C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 5.6164 |
| logD: | 5.6157 |
| logSw: | -5.5499 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.99 |
| InChI Key: | NKWOWUKVGJLKEQ-UHFFFAOYSA-N |