[rel-(3aR,7aR)-2-benzyl-7a-(5-methyl-1,3,4-oxadiazol-2-yl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl](5-methyl-1,2-oxazol-3-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](5-methyl-1,2-oxazol-3-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](5-methyl-1,2-oxazol-3-yl)methanone
Compound characteristics
| Compound ID: | SC54-0226 |
| 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](5-methyl-1,2-oxazol-3-yl)methanone |
| Molecular Weight: | 407.47 |
| Molecular Formula: | C22 H25 N5 O3 |
| Smiles: | Cc1cc(C(N2CC[C@@]3(CN(Cc4ccccc4)C[C@@H]3C2)c2nnc(C)o2)=O)no1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.034 |
| logD: | -1.14 |
| logSw: | -2.3688 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.486 |
| InChI Key: | UCEDUJCSMSTRJD-PGRDOPGGSA-N |