rel-(3aR,7aS)-5-benzyl-2-[3-(2-methoxyphenyl)propanoyl]octahydro-6H-pyrrolo[3,4-c]pyridin-6-one
Chemical Structure Depiction of
rel-(3aR,7aS)-5-benzyl-2-[3-(2-methoxyphenyl)propanoyl]octahydro-6H-pyrrolo[3,4-c]pyridin-6-one
rel-(3aR,7aS)-5-benzyl-2-[3-(2-methoxyphenyl)propanoyl]octahydro-6H-pyrrolo[3,4-c]pyridin-6-one
Compound characteristics
| Compound ID: | SB76-0382 |
| Compound Name: | rel-(3aR,7aS)-5-benzyl-2-[3-(2-methoxyphenyl)propanoyl]octahydro-6H-pyrrolo[3,4-c]pyridin-6-one |
| Molecular Weight: | 392.5 |
| Molecular Formula: | C24 H28 N2 O3 |
| Smiles: | [H][C@@]12CN(Cc3ccccc3)C(C[C@@]2([H])CN(C1)C(CCc1ccccc1OC)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.9052 |
| logD: | 2.9052 |
| logSw: | -3.1787 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.781 |
| InChI Key: | RSVRFAYRSPPZSN-RTWAWAEBSA-N |