rel-(2R,7aS)-N-(2,2-dimethylpropyl)-2-(3-methoxyphenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
Chemical Structure Depiction of
rel-(2R,7aS)-N-(2,2-dimethylpropyl)-2-(3-methoxyphenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
rel-(2R,7aS)-N-(2,2-dimethylpropyl)-2-(3-methoxyphenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
Compound characteristics
| Compound ID: | SC91-1065 |
| Compound Name: | rel-(2R,7aS)-N-(2,2-dimethylpropyl)-2-(3-methoxyphenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide |
| Molecular Weight: | 344.45 |
| Molecular Formula: | C20 H28 N2 O3 |
| Smiles: | CC(C)(C)CNC([C@]1(C[C@@H]2CCC(N2C1)=O)c1cccc(c1)OC)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.5776 |
| logD: | 2.5776 |
| logSw: | -2.7933 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.742 |
| InChI Key: | MCHWRPBZNNCTFS-MGPUTAFESA-N |