rel-(2R,7aS)-2-(4-fluorophenyl)-N-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
Chemical Structure Depiction of
rel-(2R,7aS)-2-(4-fluorophenyl)-N-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
rel-(2R,7aS)-2-(4-fluorophenyl)-N-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
Compound characteristics
| Compound ID: | SC91-0632 |
| Compound Name: | rel-(2R,7aS)-2-(4-fluorophenyl)-N-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxohexahydro-1H-pyrrolizine-2-carboxamide |
| Molecular Weight: | 388.48 |
| Molecular Formula: | C21 H29 F N4 O2 |
| Smiles: | CN1CCN(CCNC([C@]2(C[C@@H]3CCC(N3C2)=O)c2ccc(cc2)F)=O)CC1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.4711 |
| logD: | -0.1964 |
| logSw: | -1.9413 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.227 |
| InChI Key: | DFGSEJLFOJEGIJ-GHTZIAJQSA-N |