11H-Indeno[1,2-b]quinoxalin-11-one 2-(4-ethylbenzylidene)hydrazone

Molbank

Elizaveta I. Samorodova¹  Andrei I. Khlebnikov¹  Anastasia R. Kovrizhina¹ 

[1] Kizhner Research Center, Tomsk Polytechnic University, 634050 Tomsk, Russia;

关键词: azine;    aldazine;    11H-indeno[1,2-b]quinoxalin-11-one;    DFT;    ADME;   

DOI  :  10.3390/M1299

来源: DOAJ

【 摘 要 】

11H-Indeno[1,2-b]quinoxaline derivatives present an important type of nitrogen-containing heterocyclic compound that are useful intermediate products in organic synthesis and have potential pharmaceutical applications. A new 11H-indeno[1,2-b]quinoxalin-11-one-2-(4-ethylbenzylidene)hydrazone (compound 3) was synthesized. Compound 3 is the first example of an azine derivative based on the 11H-indeno[1,2-b]quinoxaline system. The Z,E-isomerism of compound 3 was investigated by DFT calculations. Bioavailability was evaluated in silico using ADME predictions. According to the ADME results, compound 3 is potentially highly bioavailable and has potential to be used for the treatment of neuroinflammation and ischemia–reperfusion injury.

【 授权许可】

Unknown