2,5-difluoro-N-[rel-(3aR,5R,6aR)-2-(methoxyacetyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]benzamide
Chemical Structure Depiction of
2,5-difluoro-N-[rel-(3aR,5R,6aR)-2-(methoxyacetyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]benzamide
2,5-difluoro-N-[rel-(3aR,5R,6aR)-2-(methoxyacetyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]benzamide
Compound characteristics
| Compound ID: | SB75-0053 |
| Compound Name: | 2,5-difluoro-N-[rel-(3aR,5R,6aR)-2-(methoxyacetyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)octahydrocyclopenta[c]pyrrol-5-yl]benzamide |
| Molecular Weight: | 420.41 |
| Molecular Formula: | C20 H22 F2 N4 O4 |
| Smiles: | [H][C@]12C[C@H](C[C@@]2(CN(C1)C(COC)=O)c1nc(C)no1)NC(c1cc(ccc1F)F)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.6187 |
| logD: | 1.6187 |
| logSw: | -2.4162 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.811 |
| InChI Key: | YQANAMONIPXYML-ZGLRSVDFSA-N |