[rel-(3aR,7aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(2-methylpropyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl](pyridin-3-yl)methanone
Chemical Structure Depiction of
[rel-(3aR,7aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(2-methylpropyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl](pyridin-3-yl)methanone
[rel-(3aR,7aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(2-methylpropyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl](pyridin-3-yl)methanone
Compound characteristics
| Compound ID: | S839-0026 |
| Compound Name: | [rel-(3aR,7aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(2-methylpropyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl](pyridin-3-yl)methanone |
| Molecular Weight: | 369.47 |
| Molecular Formula: | C20 H27 N5 O2 |
| Smiles: | CC(C)CN1C[C@@H]2CCN(C[C@@]2(C1)c1nc(C)no1)C(c1cccnc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.4022 |
| logD: | -2.5693 |
| logSw: | -1.0573 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.594 |
| InChI Key: | LEGNIUKCUZBFMK-XLIONFOSSA-N |