1-[rel-(3aR,7aR)-2-benzyl-7a-(5-methyl-1,3,4-oxadiazol-2-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]-2-methylpropan-1-one
Chemical Structure Depiction of
1-[rel-(3aR,7aR)-2-benzyl-7a-(5-methyl-1,3,4-oxadiazol-2-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]-2-methylpropan-1-one
1-[rel-(3aR,7aR)-2-benzyl-7a-(5-methyl-1,3,4-oxadiazol-2-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]-2-methylpropan-1-one
Compound characteristics
| Compound ID: | SC54-0201 |
| Compound Name: | 1-[rel-(3aR,7aR)-2-benzyl-7a-(5-methyl-1,3,4-oxadiazol-2-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]-2-methylpropan-1-one |
| Molecular Weight: | 368.48 |
| Molecular Formula: | C21 H28 N4 O2 |
| Smiles: | CC(C)C(N1CC[C@@]2(CN(Cc3ccccc3)C[C@@H]2C1)c1nnc(C)o1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.0976 |
| logD: | -1.1345 |
| logSw: | -2.3428 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.529 |
| InChI Key: | KUQIIHNRBKOEAW-GHTZIAJQSA-N |