rel-(3aR,7aS)-5-benzyl-2-[(pyridin-2-yl)methyl]octahydro-6H-pyrrolo[3,4-c]pyridin-6-one
Chemical Structure Depiction of
rel-(3aR,7aS)-5-benzyl-2-[(pyridin-2-yl)methyl]octahydro-6H-pyrrolo[3,4-c]pyridin-6-one
rel-(3aR,7aS)-5-benzyl-2-[(pyridin-2-yl)methyl]octahydro-6H-pyrrolo[3,4-c]pyridin-6-one
Compound characteristics
| Compound ID: | SB76-0376 |
| Compound Name: | rel-(3aR,7aS)-5-benzyl-2-[(pyridin-2-yl)methyl]octahydro-6H-pyrrolo[3,4-c]pyridin-6-one |
| Molecular Weight: | 321.42 |
| Molecular Formula: | C20 H23 N3 O |
| Smiles: | [H][C@]12CN(Cc3ccccn3)C[C@]2([H])CC(N(Cc2ccccc2)C1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.7041 |
| logD: | -1.6909 |
| logSw: | -1.747 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.3051 |
| InChI Key: | NDYNIFCSMZWOBN-QZTJIDSGSA-N |