rel-(2R,7aS)-2-(2-chlorophenyl)-N-[3-(4-ethylpiperazin-1-yl)propyl]-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
Chemical Structure Depiction of
rel-(2R,7aS)-2-(2-chlorophenyl)-N-[3-(4-ethylpiperazin-1-yl)propyl]-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
rel-(2R,7aS)-2-(2-chlorophenyl)-N-[3-(4-ethylpiperazin-1-yl)propyl]-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
Compound characteristics
| Compound ID: | SC91-0505 |
| Compound Name: | rel-(2R,7aS)-2-(2-chlorophenyl)-N-[3-(4-ethylpiperazin-1-yl)propyl]-5-oxohexahydro-1H-pyrrolizine-2-carboxamide |
| Molecular Weight: | 432.99 |
| Molecular Formula: | C23 H33 Cl N4 O2 |
| Smiles: | CCN1CCN(CCCNC([C@]2(C[C@@H]3CCC(N3C2)=O)c2ccccc2[Cl])=O)CC1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.4118 |
| logD: | 0.4636 |
| logSw: | -3.0002 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.287 |
| InChI Key: | XOCCIGJKMOJVQO-FDDCHVKYSA-N |