[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl][4-(trifluoromethyl)phenyl]methanone
Chemical Structure Depiction of
[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl][4-(trifluoromethyl)phenyl]methanone
[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl][4-(trifluoromethyl)phenyl]methanone
Compound characteristics
| Compound ID: | S823-3936 |
| Compound Name: | [rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl][4-(trifluoromethyl)phenyl]methanone |
| Molecular Weight: | 316.32 |
| Molecular Formula: | C15 H19 F3 N2 O2 |
| Smiles: | CN(C)[C@@H]1CN(C[C@H]1CO)C(c1ccc(cc1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.2627 |
| logD: | 0.3054 |
| logSw: | -1.6043 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.146 |
| InChI Key: | XQRHHQDULCXCFE-WCQYABFASA-N |