2-(1-acetylpiperidin-4-yl)-N-[rel-(3aR,5R,6aR)-2-(methanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]acetamide
Chemical Structure Depiction of
2-(1-acetylpiperidin-4-yl)-N-[rel-(3aR,5R,6aR)-2-(methanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]acetamide
2-(1-acetylpiperidin-4-yl)-N-[rel-(3aR,5R,6aR)-2-(methanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]acetamide
Compound characteristics
| Compound ID: | SB75-0221 |
| Compound Name: | 2-(1-acetylpiperidin-4-yl)-N-[rel-(3aR,5R,6aR)-2-(methanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]acetamide |
| Molecular Weight: | 453.56 |
| Molecular Formula: | C20 H31 N5 O5 S |
| Smiles: | [H][C@]12C[C@H](C[C@@]2(CN(C1)S(C)(=O)=O)c1nc(C)no1)NC(CC1CCN(CC1)C(C)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.5224 |
| logD: | 0.5224 |
| logSw: | -1.8803 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 104.644 |
| InChI Key: | KQWAOWZWEVVSLE-UWVAXJGDSA-N |