1-ethyl-3-methyl-N-[rel-(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(2-methylpropanoyl)octahydrocyclopenta[c]pyrrol-5-yl]-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
1-ethyl-3-methyl-N-[rel-(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(2-methylpropanoyl)octahydrocyclopenta[c]pyrrol-5-yl]-1H-pyrazole-4-carboxamide
1-ethyl-3-methyl-N-[rel-(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(2-methylpropanoyl)octahydrocyclopenta[c]pyrrol-5-yl]-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | SB75-0135 |
| Compound Name: | 1-ethyl-3-methyl-N-[rel-(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(2-methylpropanoyl)octahydrocyclopenta[c]pyrrol-5-yl]-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 414.51 |
| Molecular Formula: | C21 H30 N6 O3 |
| Smiles: | [H][C@]12C[C@H](C[C@@]2(CN(C1)C(C(C)C)=O)c1nc(C)no1)NC(c1cn(CC)nc1C)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.5286 |
| logD: | 1.5286 |
| logSw: | -1.989 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.769 |
| InChI Key: | IROWJWXZPBYZRW-ZOCZFRKYSA-N |