[rel-(3aR,7aR)-2-benzyl-3a-(5-methyl-1,2,4-oxadiazol-3-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl](1,3-dimethyl-1H-pyrazol-4-yl)methanone
Chemical Structure Depiction of
[rel-(3aR,7aR)-2-benzyl-3a-(5-methyl-1,2,4-oxadiazol-3-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl](1,3-dimethyl-1H-pyrazol-4-yl)methanone
[rel-(3aR,7aR)-2-benzyl-3a-(5-methyl-1,2,4-oxadiazol-3-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl](1,3-dimethyl-1H-pyrazol-4-yl)methanone
Compound characteristics
| Compound ID: | SC53-0630 |
| Compound Name: | [rel-(3aR,7aR)-2-benzyl-3a-(5-methyl-1,2,4-oxadiazol-3-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl](1,3-dimethyl-1H-pyrazol-4-yl)methanone |
| Molecular Weight: | 420.51 |
| Molecular Formula: | C23 H28 N6 O2 |
| Smiles: | Cc1c(cn(C)n1)C(N1CC[C@H]2CN(Cc3ccccc3)C[C@]2(C1)c1nc(C)on1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.7392 |
| logD: | -0.8108 |
| logSw: | -2.2811 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 66.581 |
| InChI Key: | KTGNCSRGXKRMIW-CVDCTZTESA-N |