rel-(3aR,7aS)-2-benzyl-3a-(5-methyl-1,2,4-oxadiazol-3-yl)-5-[(pyridin-3-yl)methyl]octahydro-1H-pyrrolo[3,4-c]pyridine
Chemical Structure Depiction of
rel-(3aR,7aS)-2-benzyl-3a-(5-methyl-1,2,4-oxadiazol-3-yl)-5-[(pyridin-3-yl)methyl]octahydro-1H-pyrrolo[3,4-c]pyridine
rel-(3aR,7aS)-2-benzyl-3a-(5-methyl-1,2,4-oxadiazol-3-yl)-5-[(pyridin-3-yl)methyl]octahydro-1H-pyrrolo[3,4-c]pyridine
Compound characteristics
| Compound ID: | SC53-0675 |
| Compound Name: | rel-(3aR,7aS)-2-benzyl-3a-(5-methyl-1,2,4-oxadiazol-3-yl)-5-[(pyridin-3-yl)methyl]octahydro-1H-pyrrolo[3,4-c]pyridine |
| Molecular Weight: | 389.5 |
| Molecular Formula: | C23 H27 N5 O |
| Smiles: | Cc1nc([C@@]23CN(CC[C@H]3CN(Cc3ccccc3)C2)Cc2cccnc2)no1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.4445 |
| logD: | -0.0594 |
| logSw: | -2.006 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.021 |
| InChI Key: | YTLYGUOOPYWACG-FYYLOGMGSA-N |