rel-(6R,7aR)-6-(3-methylphenyl)-6-(pyrrolidine-1-carbonyl)hexahydro-3H-pyrrolizin-3-one
Chemical Structure Depiction of
rel-(6R,7aR)-6-(3-methylphenyl)-6-(pyrrolidine-1-carbonyl)hexahydro-3H-pyrrolizin-3-one
rel-(6R,7aR)-6-(3-methylphenyl)-6-(pyrrolidine-1-carbonyl)hexahydro-3H-pyrrolizin-3-one
Compound characteristics
| Compound ID: | SD57-0072 |
| Compound Name: | rel-(6R,7aR)-6-(3-methylphenyl)-6-(pyrrolidine-1-carbonyl)hexahydro-3H-pyrrolizin-3-one |
| Molecular Weight: | 312.41 |
| Molecular Formula: | C19 H24 N2 O2 |
| Smiles: | Cc1cccc(c1)[C@]1(C[C@@H]2CCC(N2C1)=O)C(N1CCCC1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.9327 |
| logD: | 1.9327 |
| logSw: | -2.3338 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.528 |
| InChI Key: | UARZYYKJQDEAOP-VQIMIIECSA-N |