rel-(6R,7aS)-6-(2-chlorophenyl)-6-[4-(pyrrolidin-1-yl)piperidine-1-carbonyl]hexahydro-3H-pyrrolizin-3-one
Chemical Structure Depiction of
rel-(6R,7aS)-6-(2-chlorophenyl)-6-[4-(pyrrolidin-1-yl)piperidine-1-carbonyl]hexahydro-3H-pyrrolizin-3-one
rel-(6R,7aS)-6-(2-chlorophenyl)-6-[4-(pyrrolidin-1-yl)piperidine-1-carbonyl]hexahydro-3H-pyrrolizin-3-one
Compound characteristics
| Compound ID: | SC91-0502 |
| Compound Name: | rel-(6R,7aS)-6-(2-chlorophenyl)-6-[4-(pyrrolidin-1-yl)piperidine-1-carbonyl]hexahydro-3H-pyrrolizin-3-one |
| Molecular Weight: | 415.96 |
| Molecular Formula: | C23 H30 Cl N3 O2 |
| Smiles: | C1CCN(C1)C1CCN(CC1)C([C@]1(C[C@@H]2CCC(N2C1)=O)c1ccccc1[Cl])=O |
| Stereo: | RELATIVE |
| logP: | 2.529 |
| logD: | -1.4634 |
| logSw: | -3.3485 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.621 |
| InChI Key: | QDWKPSLMGUNYPX-FDDCHVKYSA-N |