[rel-(3aR,7aR)-2-benzyl-3a-(5-methyl-1,2,4-oxadiazol-3-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl](2,4-dimethoxyphenyl)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](2,4-dimethoxyphenyl)methanone
[rel-(3aR,7aR)-2-benzyl-3a-(5-methyl-1,2,4-oxadiazol-3-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl](2,4-dimethoxyphenyl)methanone
Compound characteristics
| Compound ID: | SC53-0655 |
| 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](2,4-dimethoxyphenyl)methanone |
| Molecular Weight: | 462.55 |
| Molecular Formula: | C26 H30 N4 O4 |
| Smiles: | Cc1nc([C@]23CN(Cc4ccccc4)C[C@@H]3CCN(C2)C(c2ccc(cc2OC)OC)=O)no1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.2865 |
| logD: | 0.7365 |
| logSw: | -3.5277 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.593 |
| InChI Key: | RNTHSIGSNCZRJP-FNZWTVRRSA-N |