N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(oxan-4-yl)pyrrolidin-3-yl]-4-phenylbutanamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(oxan-4-yl)pyrrolidin-3-yl]-4-phenylbutanamide
N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(oxan-4-yl)pyrrolidin-3-yl]-4-phenylbutanamide
Compound characteristics
| Compound ID: | S823-1566 |
| Compound Name: | N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(oxan-4-yl)pyrrolidin-3-yl]-4-phenylbutanamide |
| Molecular Weight: | 346.47 |
| Molecular Formula: | C20 H30 N2 O3 |
| Smiles: | C(CC(N[C@@H]1CN(C[C@H]1CO)C1CCOCC1)=O)Cc1ccccc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.6165 |
| logD: | -1.8125 |
| logSw: | -1.6905 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.904 |
| InChI Key: | QIEAZEGUOIRKRY-PKOBYXMFSA-N |