[rel-(3aR,6aR)-5-[(3,5-difluorophenyl)methyl]-3a-(3-methyl-1,2,4-oxadiazol-5-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl](phenyl)methanone
Chemical Structure Depiction of
[rel-(3aR,6aR)-5-[(3,5-difluorophenyl)methyl]-3a-(3-methyl-1,2,4-oxadiazol-5-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl](phenyl)methanone
[rel-(3aR,6aR)-5-[(3,5-difluorophenyl)methyl]-3a-(3-methyl-1,2,4-oxadiazol-5-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl](phenyl)methanone
Compound characteristics
| Compound ID: | S988-0921 |
| Compound Name: | [rel-(3aR,6aR)-5-[(3,5-difluorophenyl)methyl]-3a-(3-methyl-1,2,4-oxadiazol-5-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl](phenyl)methanone |
| Molecular Weight: | 424.45 |
| Molecular Formula: | C23 H22 F2 N4 O2 |
| Smiles: | Cc1nc([C@@]23CN(Cc4cc(cc(c4)F)F)C[C@H]3CN(C2)C(c2ccccc2)=O)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.024 |
| logD: | -0.8883 |
| logSw: | -3.1135 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.104 |
| InChI Key: | URMGGXAPSGJFKN-JPYJTQIMSA-N |