[rel-(3aR,7aS)-3a-(hydroxymethyl)-5-(propan-2-yl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl](phenyl)methanone
Chemical Structure Depiction of
[rel-(3aR,7aS)-3a-(hydroxymethyl)-5-(propan-2-yl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl](phenyl)methanone
[rel-(3aR,7aS)-3a-(hydroxymethyl)-5-(propan-2-yl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl](phenyl)methanone
Compound characteristics
| Compound ID: | S996-0786 |
| Compound Name: | [rel-(3aR,7aS)-3a-(hydroxymethyl)-5-(propan-2-yl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl](phenyl)methanone |
| Molecular Weight: | 302.42 |
| Molecular Formula: | C18 H26 N2 O2 |
| Smiles: | CC(C)N1CC[C@@H]2CN(C[C@@]2(C1)CO)C(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.4842 |
| logD: | -1.7895 |
| logSw: | -1.706 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.953 |
| InChI Key: | DBOILIZGCJQQDU-SJLPKXTDSA-N |