2-(3,5-dimethyl-1H-pyrazol-1-yl)-N-[rel-(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(2-methylpropanoyl)octahydrocyclopenta[c]pyrrol-5-yl]acetamide
Chemical Structure Depiction of
2-(3,5-dimethyl-1H-pyrazol-1-yl)-N-[rel-(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(2-methylpropanoyl)octahydrocyclopenta[c]pyrrol-5-yl]acetamide
2-(3,5-dimethyl-1H-pyrazol-1-yl)-N-[rel-(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(2-methylpropanoyl)octahydrocyclopenta[c]pyrrol-5-yl]acetamide
Compound characteristics
| Compound ID: | SB75-0179 |
| Compound Name: | 2-(3,5-dimethyl-1H-pyrazol-1-yl)-N-[rel-(3aR,5R,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-(2-methylpropanoyl)octahydrocyclopenta[c]pyrrol-5-yl]acetamide |
| 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(Cn1c(C)cc(C)n1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.7921 |
| logD: | 0.7921 |
| logSw: | -1.6595 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.708 |
| InChI Key: | ZKGOUDIOXWSDCV-WWMYMODYSA-N |