[rel-(3aR,7aR)-2-benzyl-7a-(5-methyl-1,3,4-oxadiazol-2-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl](pyrimidin-2-yl)methanone
Chemical Structure Depiction of
[rel-(3aR,7aR)-2-benzyl-7a-(5-methyl-1,3,4-oxadiazol-2-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl](pyrimidin-2-yl)methanone
[rel-(3aR,7aR)-2-benzyl-7a-(5-methyl-1,3,4-oxadiazol-2-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl](pyrimidin-2-yl)methanone
Compound characteristics
| Compound ID: | SC54-0211 |
| Compound Name: | [rel-(3aR,7aR)-2-benzyl-7a-(5-methyl-1,3,4-oxadiazol-2-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl](pyrimidin-2-yl)methanone |
| Molecular Weight: | 404.47 |
| Molecular Formula: | C22 H24 N6 O2 |
| Smiles: | Cc1nnc([C@@]23CCN(C[C@H]3CN(Cc3ccccc3)C2)C(c2ncccn2)=O)o1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.4416 |
| logD: | -2.7324 |
| logSw: | -1.2913 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.693 |
| InChI Key: | LUEKGMIITDHQSQ-PGRDOPGGSA-N |