[rel-(3aR,7aS)-5-benzyl-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl](phenyl)methanone
Chemical Structure Depiction of
[rel-(3aR,7aS)-5-benzyl-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl](phenyl)methanone
[rel-(3aR,7aS)-5-benzyl-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl](phenyl)methanone
Compound characteristics
| Compound ID: | S839-0133 |
| Compound Name: | [rel-(3aR,7aS)-5-benzyl-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydro-2H-pyrrolo[3,4-c]pyridin-2-yl](phenyl)methanone |
| Molecular Weight: | 402.5 |
| Molecular Formula: | C24 H26 N4 O2 |
| Smiles: | Cc1nc([C@@]23CN(CC[C@H]3CN(C2)C(c2ccccc2)=O)Cc2ccccc2)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.8557 |
| logD: | 1.4227 |
| logSw: | -2.8662 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.804 |
| InChI Key: | WFXSZOIMXFNCFO-XUZZJYLKSA-N |