[rel-(3aR,7aS)-2-benzyl-5-({4-[(propan-2-yl)oxy]phenyl}methyl)octahydro-7aH-pyrrolo[3,4-c]pyridin-7a-yl]methanol
Chemical Structure Depiction of
[rel-(3aR,7aS)-2-benzyl-5-({4-[(propan-2-yl)oxy]phenyl}methyl)octahydro-7aH-pyrrolo[3,4-c]pyridin-7a-yl]methanol
[rel-(3aR,7aS)-2-benzyl-5-({4-[(propan-2-yl)oxy]phenyl}methyl)octahydro-7aH-pyrrolo[3,4-c]pyridin-7a-yl]methanol
Compound characteristics
| Compound ID: | CM2432-0321 |
| Compound Name: | [rel-(3aR,7aS)-2-benzyl-5-({4-[(propan-2-yl)oxy]phenyl}methyl)octahydro-7aH-pyrrolo[3,4-c]pyridin-7a-yl]methanol |
| Molecular Weight: | 394.56 |
| Molecular Formula: | C25 H34 N2 O2 |
| Smiles: | CC(C)Oc1ccc(CN2CC[C@@]3(CN(Cc4ccccc4)C[C@@H]3C2)CO)cc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.5492 |
| logD: | -0.0171 |
| logSw: | -3.323 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.5161 |
| InChI Key: | XEWOBNKPCRNHMM-UKILVPOCSA-N |