1-[rel-(3aR,7aR)-2-benzyl-3a-(5-methyl-1,2,4-oxadiazol-3-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]-2-(morpholin-4-yl)ethan-1-one
Chemical Structure Depiction of
1-[rel-(3aR,7aR)-2-benzyl-3a-(5-methyl-1,2,4-oxadiazol-3-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]-2-(morpholin-4-yl)ethan-1-one
1-[rel-(3aR,7aR)-2-benzyl-3a-(5-methyl-1,2,4-oxadiazol-3-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]-2-(morpholin-4-yl)ethan-1-one
Compound characteristics
| Compound ID: | SC53-0604 |
| Compound Name: | 1-[rel-(3aR,7aR)-2-benzyl-3a-(5-methyl-1,2,4-oxadiazol-3-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]-2-(morpholin-4-yl)ethan-1-one |
| Molecular Weight: | 425.53 |
| Molecular Formula: | C23 H31 N5 O3 |
| Smiles: | Cc1nc([C@]23CN(Cc4ccccc4)C[C@@H]3CCN(C2)C(CN2CCOCC2)=O)no1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.2755 |
| logD: | -1.3325 |
| logSw: | -1.6376 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.805 |
| InChI Key: | JOYDGYIYCWJCJE-REWPJTCUSA-N |