[rel-(3aR,7aR)-2-benzyl-3a-(5-methyl-1,2,4-oxadiazol-3-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl](2-ethoxyphenyl)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](2-ethoxyphenyl)methanone
[rel-(3aR,7aR)-2-benzyl-3a-(5-methyl-1,2,4-oxadiazol-3-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl](2-ethoxyphenyl)methanone
Compound characteristics
| Compound ID: | SC53-0664 |
| 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](2-ethoxyphenyl)methanone |
| Molecular Weight: | 446.55 |
| Molecular Formula: | C26 H30 N4 O3 |
| Smiles: | CCOc1ccccc1C(N1CC[C@H]2CN(Cc3ccccc3)C[C@]2(C1)c1nc(C)on1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.5408 |
| logD: | 0.9908 |
| logSw: | -3.5273 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.63 |
| InChI Key: | BVDXAUDJMKEBRE-LVXARBLLSA-N |