[rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl](pyridin-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](pyridin-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](pyridin-4-yl)methanone
Compound characteristics
Compound ID: | S988-0159 |
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](pyridin-4-yl)methanone |
Molecular Weight: | 383.45 |
Molecular Formula: | C20 H25 N5 O3 |
Smiles: | Cc1nc([C@]23CN(C[C@@H]3CN(C2)C(c2ccncc2)=O)C2CCOCC2)on1 |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 0.249 |
logD: | -5.4486 |
logSw: | -0.7011 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 68.993 |
InChI Key: | LHVJRIQERRQFEL-UZLBHIALSA-N |