N-[rel-(3aR,5R,6aR)-2-(1H-indazole-3-carbonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]ethanesulfonamide
Chemical Structure Depiction of
N-[rel-(3aR,5R,6aR)-2-(1H-indazole-3-carbonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]ethanesulfonamide
N-[rel-(3aR,5R,6aR)-2-(1H-indazole-3-carbonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]ethanesulfonamide
Compound characteristics
| Compound ID: | SB75-1336 |
| Compound Name: | N-[rel-(3aR,5R,6aR)-2-(1H-indazole-3-carbonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]ethanesulfonamide |
| Molecular Weight: | 444.51 |
| Molecular Formula: | C20 H24 N6 O4 S |
| Smiles: | [H][C@]12C[C@H](C[C@@]2(CN(C1)C(c1c2ccccc2[nH]n1)=O)c1nc(C)no1)NS(CC)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.6868 |
| logD: | 1.6868 |
| logSw: | -2.5855 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 115.347 |
| InChI Key: | GQUDGQRZOQVRJA-JZKQVHKSSA-N |