N-[rel-(3aR,5R,6aR)-2-(1-methyl-1H-imidazole-4-sulfonyl)-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-(1-methyl-1H-imidazole-4-sulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]ethanesulfonamide
N-[rel-(3aR,5R,6aR)-2-(1-methyl-1H-imidazole-4-sulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]ethanesulfonamide
Compound characteristics
| Compound ID: | SB75-1283 |
| Compound Name: | N-[rel-(3aR,5R,6aR)-2-(1-methyl-1H-imidazole-4-sulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]ethanesulfonamide |
| Molecular Weight: | 444.53 |
| Molecular Formula: | C16 H24 N6 O5 S2 |
| Smiles: | [H][C@]12C[C@H](C[C@@]2(CN(C1)S(c1cn(C)cn1)(=O)=O)c1nc(C)no1)NS(CC)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.0222 |
| logD: | 0.0222 |
| logSw: | -2.0863 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 119.574 |
| InChI Key: | WVBVKABURKBSIK-WWGRRREGSA-N |