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Synthesis, characterization, quantum chemical studies and electrochemical performance of new 4,7-dihydrotetrazolo[1,5-a]pyrimidine derivatives

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Abstract

In this study, 4,7-\(\hbox {dihydrotetrazolo}[1,5\hbox {-}a]\hbox {pyrimidine}\) derivatives (1–5) were prepared via Multicomponent Cyclocondensation Reactions (MCRs). All structures were determined by using FT-IR, \(^{1}\hbox {H/}^{13}\hbox {C}\) NMR and elemental analyses. The compounds were investigated as corrosion inhibitors using density functional theory (DFT) at the level of B3LYP/6-31G (d, p). According to the calculations, compound 1 appears to be a good inhibitor for corrosion. In addition, the electrochemical properties of the novel systems were investigated by CV.

Graphical Abstract:

The synthesis, characterization, quantum chemical studies and electrochemical performance of new 4,7-\(\hbox {dihydrotetrazolo}[1,5\hbox {-}a]\hbox {pyrimidine}\) derivatives are reported.

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Acknowledgements

This work was supported by the Van Yuzuncu Yil University of Turkey FYL-2018-6661.

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Authors and Affiliations

  1. Department of Chemistry, Faculty of Science, Van Yuzuncu Yil University, 65080, Van, Turkey

    Esvet Akbas & Savas Celik

  2. Department of Property Protection and Security, Van Security Vocational School, Van Yuzuncu Yil University, 65080, Van, Turkey

    Erdem Ergan

  3. Department of Analytical Chemistry, Faculty of Science and Art, Batman University, 72100, Batman, Turkey

    Abdulkadir Levent

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  1. Esvet Akbas
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  2. Savas Celik
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  4. Abdulkadir Levent
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Correspondence to Esvet Akbas.

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Akbas, E., Celik, S., Ergan, E. et al. Synthesis, characterization, quantum chemical studies and electrochemical performance of new 4,7-dihydrotetrazolo[1,5-a]pyrimidine derivatives. J Chem Sci 131, 30 (2019). https://doi.org/10.1007/s12039-019-1602-0

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