N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-methylpyrrolidin-3-yl}-4-ethoxybenzamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-methylpyrrolidin-3-yl}-4-ethoxybenzamide
N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-methylpyrrolidin-3-yl}-4-ethoxybenzamide
Compound characteristics
| Compound ID: | S639-0049 |
| Compound Name: | N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-methylpyrrolidin-3-yl}-4-ethoxybenzamide |
| Molecular Weight: | 305.42 |
| Molecular Formula: | C17 H27 N3 O2 |
| Smiles: | CCOc1ccc(cc1)C(N[C@@H]1CN(C)C[C@H]1CN(C)C)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.1601 |
| logD: | -0.9861 |
| logSw: | -2.1311 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.487 |
| InChI Key: | HMZIESSNMAIIJX-HOCLYGCPSA-N |