rel-(3R,4R)-3-(1-acetylpiperidin-4-yl)-4-(phenoxymethyl)-N-propylpyrrolidine-1-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-3-(1-acetylpiperidin-4-yl)-4-(phenoxymethyl)-N-propylpyrrolidine-1-carboxamide
rel-(3R,4R)-3-(1-acetylpiperidin-4-yl)-4-(phenoxymethyl)-N-propylpyrrolidine-1-carboxamide
Compound characteristics
| Compound ID: | S995-0727 |
| Compound Name: | rel-(3R,4R)-3-(1-acetylpiperidin-4-yl)-4-(phenoxymethyl)-N-propylpyrrolidine-1-carboxamide |
| Molecular Weight: | 387.52 |
| Molecular Formula: | C22 H33 N3 O3 |
| Smiles: | CCCNC(N1C[C@@H](COc2ccccc2)[C@@H](C1)C1CCN(CC1)C(C)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.3258 |
| logD: | 3.3258 |
| logSw: | -3.3131 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.719 |
| InChI Key: | URWJTLNGPXMZRJ-FPOVZHCZSA-N |