rel-(6R,7aS)-6-(3-methylphenyl)-6-(4-methylpiperidine-1-carbonyl)hexahydro-3H-pyrrolizin-3-one
Chemical Structure Depiction of
rel-(6R,7aS)-6-(3-methylphenyl)-6-(4-methylpiperidine-1-carbonyl)hexahydro-3H-pyrrolizin-3-one
rel-(6R,7aS)-6-(3-methylphenyl)-6-(4-methylpiperidine-1-carbonyl)hexahydro-3H-pyrrolizin-3-one
Compound characteristics
| Compound ID: | SC91-0803 |
| Compound Name: | rel-(6R,7aS)-6-(3-methylphenyl)-6-(4-methylpiperidine-1-carbonyl)hexahydro-3H-pyrrolizin-3-one |
| Molecular Weight: | 340.46 |
| Molecular Formula: | C21 H28 N2 O2 |
| Smiles: | CC1CCN(CC1)C([C@]1(C[C@@H]2CCC(N2C1)=O)c1cccc(C)c1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.5503 |
| logD: | 2.5503 |
| logSw: | -2.5181 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.162 |
| InChI Key: | GEKPXJZNTWKTRV-GHTZIAJQSA-N |