2-fluoro-N-[rel-(3aR,5R,6aR)-2-(methoxyacetyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]benzene-1-sulfonamide
Chemical Structure Depiction of
2-fluoro-N-[rel-(3aR,5R,6aR)-2-(methoxyacetyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]benzene-1-sulfonamide
2-fluoro-N-[rel-(3aR,5R,6aR)-2-(methoxyacetyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]benzene-1-sulfonamide
Compound characteristics
Compound ID: | SB75-0065 |
Compound Name: | 2-fluoro-N-[rel-(3aR,5R,6aR)-2-(methoxyacetyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]benzene-1-sulfonamide |
Molecular Weight: | 438.48 |
Molecular Formula: | C19 H23 F N4 O5 S |
Smiles: | [H][C@]12C[C@H](C[C@@]2(CN(C1)C(COC)=O)c1nc(C)no1)NS(c1ccccc1F)(=O)=O |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 0.8598 |
logD: | 0.8597 |
logSw: | -2.3454 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 98.369 |
InChI Key: | AUFCBJQLKHVKJM-LPMFXHHGSA-N |