Ultrasound-assisted green synthesis and in silico study of 6-(4-(butylamino)-6-(diethylamino)-1,3,5-triazin-2-yl)oxypyridazine derivatives

Tiruhi Gomktsyan, Angelina Khachatryan, Diana Avakyan,Lernik Hunanyan,Roza Shainova,Armen Karapetyan,Emma Ghazaryan,Asya Vorskanyan, Margarita Dovlatyan, Yana Gharibyan,Aleksandr Yengoyan,Vergush Pivazyan

Green Processing and Synthesis(2023)

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摘要
Eco-friendly ultrasound-assisted synthesis of a series of 3-N-substituted 6-((4-(butylamino)-6-(diethylamino)-1,3,5-triazin-2-yl)oxy)pyridazin-3(2H)-one derivatives and in silico study to predict their biological activities were carried out. Physicochemical and pharmacokinetic properties were obtained. Absorption, distribution, metabolism, excretion and toxicity properties and bioavailability index were calculated. A comparative analysis of structural similarity based on the Tanimoto coefficient was carried out.
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ultrasound-assisted synthesis,green chemistry,6-(1,3,5-triazin-2-yl)oxypyridazine,in silico study
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