Facultatea de Chimie şi Tehnologie Chimică / Faculty of Chemistry and Chemical Technology

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Start date: 2024Subject: search.filters.subject.tiosemicarbazone

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    Compuși coordinativi ai fierului(III) cu unele tiosemicarbazone N(4) – substituite ale derivaților salicil aldehidei și cinam aldehidei [Articol]
    (CEP USM, 2024) Bîrcă, Maria; Rusnac, Roman; Gulea, Aurelian
    In this paper, the purpose of synthesis of Fe(III) coordination compounds with some N(4)-substituted thiosemicarbazones of salicyl aldehyde and cinnam aldehyde derivatives was pursued: which contain as a radical in the N(4) position: tert-butyl, cyclohexyl; allyl, methyl. The structure of thiosemicarbazones HnL1-5 was confirmed by FTIR spectroscopy and TLC analysis, melting point and NMR spectra. Based on the above-mentioned ligands, 5 coordination combinations were obtained, the research of which was carried out with the help of infrared spectroscopy. All synthesized compounds are being researched for their biological properties: antimicrobial and antifungal, as well as antioxidant capacities.
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    Synthesis, computational pharmacokinetics report, admet study and molecular docking of new thiosemicarbazones potential inhibitors of her2 - positive breast cancer [Articol]
    (CEP USM, 2024) Rusnac, Roman; Ciursin, Andrei; Gulea, Aurelian
    To maintain a high level of healthcare, humanity needs to develop new drugs. Thiosemicarbazones represent a very interesting class of substances from the point of view of their biological activities. Despite this, their use is very limited due to their toxicity. To solve this problem, it is possible to synthesize thiosemicarbazones based on natural substances. This can reduce their toxicity without loss of effectiveness. a number of computational methods can be used for the design and preliminary evaluation of thiosemicarbazones, which will help eliminate many unsuitable candidates. This will help reduce the cost and speed up the pace of development of new effective substances from this class. such methods include aDMeT calculations and molecular docking.
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    Combinații coordinative ale Cuprului(II) Cu ({(2 [(piridin-2-il)metiliden]hidrazincarbotioil} amino) acetat de etil cu proprietăți antioxidative [Articol]
    (CEP USM, 2024) Bîrcă, Maria; Rusnac, Anna; Garbuz, Olga; Evtodienco, Carolina; Gulea, Aurelian
    In this work, ethyl 2-isothiocyanatoacetate and [(hydrazinecarbotyoyl)amino]ethyl acetate, which are precursors of thiosemicarbazones, were synthesized.Based on these compounds, the synthesis of two new thiosemicarbazones ethyl 2-(2-(pyridin-2-ylmethylene)hydrazinecarbothioamido)acetate (Hl1) and ethyl 2-(2-(1-(pyridin-2-yl)-ethylidene)hydrazinecarbothioamide)acetate (Hl2) with yields between 85-88%. The thiosemicarbazones obtained were confrmed using 1H and 13C-nMR and FTIR spectroscopy. For the frst time, 8 coordination compounds were obtained based on thiosemicarbazone (Hl1 - Hl2) and Cu(II) salts: [Cu(l1)Br], [Cu(l1)(H2O)Cl], [Cu(l1)nO3], [Cu(l1)(H2O)ClO4], [Cu(l2)Br], [Cu(l2)(H2O)Cl], [Cu(l2)nO3], [Cu(l2)(H2O) ClO 4]. The composition of the synthesized coordination compounds was determined by elemental metal analysis and IR spectroscopy.For the synthesized compounds, the antioxidant capacity was evaluated by means of the aBTs method. In which ethyl 2-(2-(pyridin-2-ylmethylene)hydrazinecarbothioamido)acetate (Hl1) and ethyl 2-(2-(1-(pyridin-2-yl)ethylidene)hydrazinecarbothioamido)acetate (Hl2) were shown to exhibit the best results compared to the reference substance Trolox.