[rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl](pyrimidin-4-yl)methanone
Chemical Structure Depiction of
[rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl](pyrimidin-4-yl)methanone
[rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl](pyrimidin-4-yl)methanone
Compound characteristics
Compound ID: | S988-0154 |
Compound Name: | [rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl](pyrimidin-4-yl)methanone |
Molecular Weight: | 384.44 |
Molecular Formula: | C19 H24 N6 O3 |
Smiles: | Cc1nc([C@]23CN(C[C@@H]3CN(C2)C(c2ccncn2)=O)C2CCOCC2)on1 |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | -0.0158 |
logD: | -5.7134 |
logSw: | -1.002 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 79.755 |
InChI Key: | CJKQMACZJJIHCN-KUHUBIRLSA-N |