N-{rel-(3R,4S)-1-acetyl-4-[(dimethylamino)methyl]pyrrolidin-3-yl}-2-[4-(trifluoromethoxy)phenyl]acetamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-1-acetyl-4-[(dimethylamino)methyl]pyrrolidin-3-yl}-2-[4-(trifluoromethoxy)phenyl]acetamide
N-{rel-(3R,4S)-1-acetyl-4-[(dimethylamino)methyl]pyrrolidin-3-yl}-2-[4-(trifluoromethoxy)phenyl]acetamide
Compound characteristics
| Compound ID: | S639-2652 |
| Compound Name: | N-{rel-(3R,4S)-1-acetyl-4-[(dimethylamino)methyl]pyrrolidin-3-yl}-2-[4-(trifluoromethoxy)phenyl]acetamide |
| Molecular Weight: | 387.4 |
| Molecular Formula: | C18 H24 F3 N3 O3 |
| Smiles: | CC(N1C[C@H]([C@H](CN(C)C)C1)NC(Cc1ccc(cc1)OC(F)(F)F)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.594 |
| logD: | -1.221 |
| logSw: | -1.9677 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.806 |
| InChI Key: | QKIARNCFJRUILC-HOCLYGCPSA-N |