(5-fluoropyridin-2-yl)[rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]methanone
Chemical Structure Depiction of
(5-fluoropyridin-2-yl)[rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]methanone
(5-fluoropyridin-2-yl)[rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]methanone
Compound characteristics
| Compound ID: | S988-1271 |
| Compound Name: | (5-fluoropyridin-2-yl)[rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]methanone |
| Molecular Weight: | 401.44 |
| Molecular Formula: | C20 H24 F N5 O3 |
| Smiles: | Cc1nc([C@]23CN(C[C@@H]3CN(C2)C(c2ccc(cn2)F)=O)C2CCOCC2)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.1554 |
| logD: | -4.5421 |
| logSw: | -1.7625 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.703 |
| InChI Key: | CGRQCQHIRZEDBN-VLIAUNLRSA-N |