[rel-(3aR,7aS)-5-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-(propan-2-yl)octahydro-3aH-pyrrolo[3,4-c]pyridin-3a-yl]methanol
Chemical Structure Depiction of
[rel-(3aR,7aS)-5-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-(propan-2-yl)octahydro-3aH-pyrrolo[3,4-c]pyridin-3a-yl]methanol
[rel-(3aR,7aS)-5-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-(propan-2-yl)octahydro-3aH-pyrrolo[3,4-c]pyridin-3a-yl]methanol
Compound characteristics
| Compound ID: | S858-0577 |
| Compound Name: | [rel-(3aR,7aS)-5-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-(propan-2-yl)octahydro-3aH-pyrrolo[3,4-c]pyridin-3a-yl]methanol |
| Molecular Weight: | 306.45 |
| Molecular Formula: | C17 H30 N4 O |
| Smiles: | CC(C)N1C[C@@H]2CCN(Cc3c(C)n[nH]c3C)C[C@@]2(C1)CO |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.2174 |
| logD: | -3.8524 |
| logSw: | -1.0733 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.952 |
| InChI Key: | LEMGAVFHIQXGLJ-DOTOQJQBSA-N |