rel-(6R,7aS)-6-(2-chlorophenyl)-6-[4-(2-methylphenyl)piperazine-1-carbonyl]hexahydro-3H-pyrrolizin-3-one
Chemical Structure Depiction of
rel-(6R,7aS)-6-(2-chlorophenyl)-6-[4-(2-methylphenyl)piperazine-1-carbonyl]hexahydro-3H-pyrrolizin-3-one
rel-(6R,7aS)-6-(2-chlorophenyl)-6-[4-(2-methylphenyl)piperazine-1-carbonyl]hexahydro-3H-pyrrolizin-3-one
Compound characteristics
| Compound ID: | SC91-0532 |
| Compound Name: | rel-(6R,7aS)-6-(2-chlorophenyl)-6-[4-(2-methylphenyl)piperazine-1-carbonyl]hexahydro-3H-pyrrolizin-3-one |
| Molecular Weight: | 437.97 |
| Molecular Formula: | C25 H28 Cl N3 O2 |
| Smiles: | Cc1ccccc1N1CCN(CC1)C([C@]1(C[C@@H]2CCC(N2C1)=O)c1ccccc1[Cl])=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.8587 |
| logD: | 3.8586 |
| logSw: | -4.2187 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 37.121 |
| InChI Key: | ZNOWXEWBGBDBQI-UQBPGWFLSA-N |