2-{[4-(dimethylamino)phenyl]methylidene}-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexan-1-one
Chemical Structure Depiction of
2-{[4-(dimethylamino)phenyl]methylidene}-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexan-1-one
2-{[4-(dimethylamino)phenyl]methylidene}-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexan-1-one
Compound characteristics
| Compound ID: | 5634-0237 |
| Compound Name: | 2-{[4-(dimethylamino)phenyl]methylidene}-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexan-1-one |
| Molecular Weight: | 325.33 |
| Molecular Formula: | C17 H18 F3 N O2 |
| Smiles: | CN(C)c1ccc(\C=C2/CCC\C(=C(/C(F)(F)F)O)C2=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9037 |
| logD: | 2.1241 |
| logSw: | -4.0276 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.661 |
| InChI Key: | NDHYTYCZKIARRD-UHFFFAOYSA-N |