3-hydroxy-1-[rel-(3aR,7aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(pyridine-3-carbonyl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl]propan-1-one
Chemical Structure Depiction of
3-hydroxy-1-[rel-(3aR,7aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(pyridine-3-carbonyl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl]propan-1-one
3-hydroxy-1-[rel-(3aR,7aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(pyridine-3-carbonyl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl]propan-1-one
Compound characteristics
| Compound ID: | S839-0082 |
| Compound Name: | 3-hydroxy-1-[rel-(3aR,7aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(pyridine-3-carbonyl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl]propan-1-one |
| Molecular Weight: | 385.42 |
| Molecular Formula: | C19 H23 N5 O4 |
| Smiles: | Cc1nc([C@]23CN(C[C@@H]3CCN(C2)C(c2cccnc2)=O)C(CCO)=O)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -1.1776 |
| logD: | -1.1777 |
| logSw: | -0.4625 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.637 |
| InChI Key: | HRMYFQNLTHDUFU-HNAYVOBHSA-N |