[rel-(3aR,7aS)-7a-(hydroxymethyl)-5-(2-methylpropyl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl](4-methylpyridin-3-yl)methanone
Chemical Structure Depiction of
[rel-(3aR,7aS)-7a-(hydroxymethyl)-5-(2-methylpropyl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl](4-methylpyridin-3-yl)methanone
[rel-(3aR,7aS)-7a-(hydroxymethyl)-5-(2-methylpropyl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl](4-methylpyridin-3-yl)methanone
Compound characteristics
| Compound ID: | CM2432-1565 |
| Compound Name: | [rel-(3aR,7aS)-7a-(hydroxymethyl)-5-(2-methylpropyl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl](4-methylpyridin-3-yl)methanone |
| Molecular Weight: | 331.46 |
| Molecular Formula: | C19 H29 N3 O2 |
| Smiles: | CC(C)CN1CC[C@@]2(CN(C[C@@H]2C1)C(c1cnccc1C)=O)CO |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.5338 |
| logD: | -1.2091 |
| logSw: | -1.6054 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.419 |
| InChI Key: | AKMVHXFHHJKTPU-VQIMIIECSA-N |