[rel-(3aR,7aR)-2-benzyl-3a-(5-methyl-1,2,4-oxadiazol-3-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl](1-ethyl-1H-pyrazol-3-yl)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](1-ethyl-1H-pyrazol-3-yl)methanone
[rel-(3aR,7aR)-2-benzyl-3a-(5-methyl-1,2,4-oxadiazol-3-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl](1-ethyl-1H-pyrazol-3-yl)methanone
Compound characteristics
| Compound ID: | SC53-1048 |
| 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](1-ethyl-1H-pyrazol-3-yl)methanone |
| Molecular Weight: | 420.51 |
| Molecular Formula: | C23 H28 N6 O2 |
| Smiles: | CCn1ccc(C(N2CC[C@H]3CN(Cc4ccccc4)C[C@]3(C2)c2nc(C)on2)=O)n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.1389 |
| logD: | -0.4111 |
| logSw: | -2.3013 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.804 |
| InChI Key: | NMQABFHISSIUHO-CVDCTZTESA-N |