1-[rel-(3aR,7aS)-5-acetyl-3a-(methoxymethyl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl]-3-phenylpropan-1-one
Chemical Structure Depiction of
1-[rel-(3aR,7aS)-5-acetyl-3a-(methoxymethyl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl]-3-phenylpropan-1-one
1-[rel-(3aR,7aS)-5-acetyl-3a-(methoxymethyl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl]-3-phenylpropan-1-one
Compound characteristics
| Compound ID: | S996-0871 |
| Compound Name: | 1-[rel-(3aR,7aS)-5-acetyl-3a-(methoxymethyl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl]-3-phenylpropan-1-one |
| Molecular Weight: | 344.45 |
| Molecular Formula: | C20 H28 N2 O3 |
| Smiles: | CC(N1CC[C@@H]2CN(C[C@@]2(C1)COC)C(CCc1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.6852 |
| logD: | 1.6852 |
| logSw: | -1.7932 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.066 |
| InChI Key: | OIJXPLBNNVJUNO-UYAOXDASSA-N |