(3,5-dimethyl-1,2-oxazol-4-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
(3,5-dimethyl-1,2-oxazol-4-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
(3,5-dimethyl-1,2-oxazol-4-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: | S988-0192 |
| Compound Name: | (3,5-dimethyl-1,2-oxazol-4-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: | 401.46 |
| Molecular Formula: | C20 H27 N5 O4 |
| Smiles: | Cc1c(C(N2C[C@H]3CN(C[C@]3(C2)c2nc(C)no2)C2CCOCC2)=O)c(C)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.647 |
| logD: | -5.0506 |
| logSw: | -0.8029 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 81.603 |
| InChI Key: | BMMQHLFAKHYSEI-QRWLVFNGSA-N |