2-({[5-(hydroxymethyl)-1-{[3-(trifluoromethyl)phenyl]methyl}-1H-imidazol-2-yl]sulfanyl}methyl)benzonitrile
Chemical Structure Depiction of
2-({[5-(hydroxymethyl)-1-{[3-(trifluoromethyl)phenyl]methyl}-1H-imidazol-2-yl]sulfanyl}methyl)benzonitrile
2-({[5-(hydroxymethyl)-1-{[3-(trifluoromethyl)phenyl]methyl}-1H-imidazol-2-yl]sulfanyl}methyl)benzonitrile
Compound characteristics
| Compound ID: | V030-9936 |
| Compound Name: | 2-({[5-(hydroxymethyl)-1-{[3-(trifluoromethyl)phenyl]methyl}-1H-imidazol-2-yl]sulfanyl}methyl)benzonitrile |
| Molecular Weight: | 403.42 |
| Molecular Formula: | C20 H16 F3 N3 O S |
| Salt: | not_available |
| Smiles: | C(c1cccc(c1)C(F)(F)F)n1c(CO)cnc1SCc1ccccc1C#N |
| Stereo: | ACHIRAL |
| logP: | 4.1934 |
| logD: | 4.1884 |
| logSw: | -4.3754 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.415 |
| InChI Key: | ABHNWURWXKZKMR-UHFFFAOYSA-N |