rel-(3aR,7aS)-2-(1-acetylpiperidin-4-yl)-5-benzyloctahydro-6H-pyrrolo[3,4-c]pyridin-6-one
Chemical Structure Depiction of
rel-(3aR,7aS)-2-(1-acetylpiperidin-4-yl)-5-benzyloctahydro-6H-pyrrolo[3,4-c]pyridin-6-one
rel-(3aR,7aS)-2-(1-acetylpiperidin-4-yl)-5-benzyloctahydro-6H-pyrrolo[3,4-c]pyridin-6-one
Compound characteristics
| Compound ID: | SB76-0313 |
| Compound Name: | rel-(3aR,7aS)-2-(1-acetylpiperidin-4-yl)-5-benzyloctahydro-6H-pyrrolo[3,4-c]pyridin-6-one |
| Molecular Weight: | 355.48 |
| Molecular Formula: | C21 H29 N3 O2 |
| Smiles: | [H][C@]12CN(C[C@]2([H])CC(N(Cc2ccccc2)C1)=O)C1CCN(CC1)C(C)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.5459 |
| logD: | -4.4792 |
| logSw: | -1.7549 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.511 |
| InChI Key: | PEXMJDIDKYKNNG-RTBURBONSA-N |