rel-(3aR,7aS)-5-benzyl-2-cyclohexyloctahydro-6H-pyrrolo[3,4-c]pyridin-6-one
Chemical Structure Depiction of
rel-(3aR,7aS)-5-benzyl-2-cyclohexyloctahydro-6H-pyrrolo[3,4-c]pyridin-6-one
rel-(3aR,7aS)-5-benzyl-2-cyclohexyloctahydro-6H-pyrrolo[3,4-c]pyridin-6-one
Compound characteristics
| Compound ID: | SB76-0380 |
| Compound Name: | rel-(3aR,7aS)-5-benzyl-2-cyclohexyloctahydro-6H-pyrrolo[3,4-c]pyridin-6-one |
| Molecular Weight: | 312.45 |
| Molecular Formula: | C20 H28 N2 O |
| Smiles: | [H][C@]12CN(C[C@]2([H])CC(N(Cc2ccccc2)C1)=O)C1CCCCC1 |
| Stereo: | RELATIVE |
| logP: | 3.0928 |
| logD: | -2.1165 |
| logSw: | -2.9983 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.315 |
| InChI Key: | JZQBVQDEGGRRHI-QZTJIDSGSA-N |