Citation:
GUO Feng-Jiao, SUN Juan, ZHOU Wei, ZHU Hai-Liang. Synthesis, Structure and Biological Evaluation of Thiourea Derivatives as Antitumor Agents[J]. Chinese Journal of Structural Chemistry,
2014, 33(1): 79-84.
Synthesis, Structure and Biological Evaluation of Thiourea Derivatives as Antitumor Agents
摘要:
Two substituted-3-phenylthiourea derivatives have been synthesized and characterized by elemental analysis, 1H NMR, MS and single-crystal X-ray diffraction. Structural stabilization of them followed by intramolecular as well as intermolecular H-bonds makes these molecules as perfect examples in molecular recognition with self-complementary donor and acceptor units within a single molecule. The antitumor activities of compounds 1 and 2 against breast adeno carcinoma cell line MCF-7 have been evaluated by MTT method. Docking simulations have also been performed to position compounds into the telomerase active sites so as to determine their probable binding models.
English
Synthesis, Structure and Biological Evaluation of Thiourea Derivatives as Antitumor Agents
Abstract:
Two substituted-3-phenylthiourea derivatives have been synthesized and characterized by elemental analysis, 1H NMR, MS and single-crystal X-ray diffraction. Structural stabilization of them followed by intramolecular as well as intermolecular H-bonds makes these molecules as perfect examples in molecular recognition with self-complementary donor and acceptor units within a single molecule. The antitumor activities of compounds 1 and 2 against breast adeno carcinoma cell line MCF-7 have been evaluated by MTT method. Docking simulations have also been performed to position compounds into the telomerase active sites so as to determine their probable binding models.
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Key words:
- phenylthiourea derivatives
- / crystal structure
- / antitumor activity
- / docking simulation
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