[rel-(3aR,7aR)-2-benzyl-7a-(5-methyl-1,3,4-oxadiazol-2-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl](1,5-dimethyl-1H-pyrazol-3-yl)methanone
Chemical Structure Depiction of
[rel-(3aR,7aR)-2-benzyl-7a-(5-methyl-1,3,4-oxadiazol-2-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl](1,5-dimethyl-1H-pyrazol-3-yl)methanone
[rel-(3aR,7aR)-2-benzyl-7a-(5-methyl-1,3,4-oxadiazol-2-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl](1,5-dimethyl-1H-pyrazol-3-yl)methanone
Compound characteristics
| Compound ID: | SC54-0243 |
| Compound Name: | [rel-(3aR,7aR)-2-benzyl-7a-(5-methyl-1,3,4-oxadiazol-2-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl](1,5-dimethyl-1H-pyrazol-3-yl)methanone |
| Molecular Weight: | 420.51 |
| Molecular Formula: | C23 H28 N6 O2 |
| Smiles: | Cc1cc(C(N2CC[C@@]3(CN(Cc4ccccc4)C[C@@H]3C2)c2nnc(C)o2)=O)nn1C |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.2838 |
| logD: | -1.8902 |
| logSw: | -1.7984 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.744 |
| InChI Key: | DNJQYLXVUSWOIQ-WMZHIEFXSA-N |