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Investigation of the structure and prediction of the biological activity of 1,3-bis(3-cyano-6,6-dimethyl- 2-oxo-5,6-dihydro-2H-pyran-4-yl)- 2-(4-methoxyphenyl)propane*

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Chemistry of Heterocyclic Compounds Aims and scope

Single crystals of 1,3-bis(3-cyano-6,6-dimethyl-2-oxo-5,6-dihydro-2H-pyran-4-yl)-2-(4-methoxyphenyl)- propane were prepared, and an X-ray crystallographic analysis was performed. The compound has a molecular structure belonging to the C1 symmetry group. The heterocyclic rings are in a distorted half-chair conformation. The crystal packing is formed by centrosymmetric dimers, in which the heterocycles turned toward the inversion center are antiparallel. The biological activity of the compound was predicted by the PASS computer system.

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Authors and Affiliations

  1. Latvian Institute of Organic Synthesis, Riga, LV-1006, Latvia

    M. Fleisher, S. Belyakov, D. Jansone, L. Leite & E. Lukevics

  2. V. N. Orekhovich Institute of Biomedical Chemistry, Russian Academy of Medical Sciences, Moscow, 119121, Russia

    V. Poroikov

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  1. M. Fleisher
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  2. S. Belyakov
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  3. D. Jansone
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  4. V. Poroikov
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  5. L. Leite
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  6. E. Lukevics
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Corresponding author

Correspondence to M. Fleisher.

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*Dedicated to Highly Respected Academician Andris Strakovs in connection with his jubilee.

Translated from Khimiya Geterotsiklicheskikh Soedinenii, No. 5, pp. 680-685, May, 2009.

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Fleisher, M., Belyakov, S., Jansone, D. et al. Investigation of the structure and prediction of the biological activity of 1,3-bis(3-cyano-6,6-dimethyl- 2-oxo-5,6-dihydro-2H-pyran-4-yl)- 2-(4-methoxyphenyl)propane*. Chem Heterocycl Comp 45, 531–535 (2009). https://doi.org/10.1007/s10593-009-0303-x

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  • DOI: https://doi.org/10.1007/s10593-009-0303-x

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