N-[rel-(3R,4S)-4-(hydroxymethyl)-1-{[2-(trifluoromethyl)phenyl]methyl}pyrrolidin-3-yl]-2-methoxyacetamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-4-(hydroxymethyl)-1-{[2-(trifluoromethyl)phenyl]methyl}pyrrolidin-3-yl]-2-methoxyacetamide
N-[rel-(3R,4S)-4-(hydroxymethyl)-1-{[2-(trifluoromethyl)phenyl]methyl}pyrrolidin-3-yl]-2-methoxyacetamide
Compound characteristics
| Compound ID: | S823-5668 |
| Compound Name: | N-[rel-(3R,4S)-4-(hydroxymethyl)-1-{[2-(trifluoromethyl)phenyl]methyl}pyrrolidin-3-yl]-2-methoxyacetamide |
| Molecular Weight: | 346.35 |
| Molecular Formula: | C16 H21 F3 N2 O3 |
| Smiles: | COCC(N[C@@H]1CN(Cc2ccccc2C(F)(F)F)C[C@H]1CO)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.061 |
| logD: | -0.166 |
| logSw: | -2.2109 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.138 |
| InChI Key: | VPOSYDQNOJSGQX-GXTWGEPZSA-N |