N-[rel-(3aR,5R,6aR)-2-(methoxyacetyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-2-(3-methyl-1H-pyrazol-1-yl)acetamide
Chemical Structure Depiction of
N-[rel-(3aR,5R,6aR)-2-(methoxyacetyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-2-(3-methyl-1H-pyrazol-1-yl)acetamide
N-[rel-(3aR,5R,6aR)-2-(methoxyacetyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-2-(3-methyl-1H-pyrazol-1-yl)acetamide
Compound characteristics
| Compound ID: | SB75-0031 |
| Compound Name: | N-[rel-(3aR,5R,6aR)-2-(methoxyacetyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]-2-(3-methyl-1H-pyrazol-1-yl)acetamide |
| Molecular Weight: | 402.45 |
| Molecular Formula: | C19 H26 N6 O4 |
| Smiles: | [H][C@]12C[C@H](C[C@@]2(CN(C1)C(COC)=O)c1nc(C)no1)NC(Cn1ccc(C)n1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.5751 |
| logD: | -0.5751 |
| logSw: | -1.5576 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.064 |
| InChI Key: | OAPRGBOSAXROIQ-VCBZYWHSSA-N |