TY  - JOUR
T1  - Design, Synthesis and in Silico Studies of New 2-MethylQuinazolin-4(3H)- Ones Derivatives
AU  - Ighilahriz - Boubchir, Karima
AU  - Benazzouz - Touami, Amina
AU  - Makhloufi - Chebli, Malika
PY  - 2024
DA  - August
Y2  - 2024
DO  - 10.55549/epstem.1523874
JF  - The Eurasia Proceedings of Science Technology Engineering and Mathematics
JO  - EPSTEM
PB  - ISRES Publishing
WT  - DergiPark
SN  - 2602-3199
SP  - 519
EP  - 525
VL  - 28
LA  - en
AB  - The concept of the green chemistry consists in the development of an environmentally friendly approach for organic synthesis using ecological and efficient protocols. In order to develop a methodology that could fit into the green chemistry field, for the synthesis of new quinazolin-4(3H)-ones derivatives via benzoxazinone, the choice was made on the use of both as catalysts, known for their efficiency, and microwave irradiations for time saving.The quinazolinone core and its derivatives form an important class of compounds, as they are present in a large family of products with broad biological activities. They generally display useful therapeutic and pharmacological properties such as anti-inflammatory, anti-convulsant, antihypertensive and antimalarial activity.The derivatives of the 2-metylquinazolin-4(3H)-ones 3a-d series was synthesized from 2- methyl benzoxazin-4(3H)-one 1 and aniline in the presence of H3PW12O40 (PW12) under microwave irradiation and solvent free conditions. The compound structures were established using IR, 1H-NMR, 13C-NMR and mass spectroscopy. The toxicity of the hydrazone derivatives was studied through ADMET (Absorption, Distribution, Metabolism, Excretion, and Toxicity) simulations using ADMET Lab 2.0 server.
KW  - Keggin-type heteropolyacids
KW  - Quinazolin-4(3H)-ones
KW  - Benzoxazin-4(3H)-one
CR  - Ighilahriz-Boubchir, K., Benazzouz-Touami, A. & Makhloufi-Chebli, M. (2024). Design, synthesis and in silico studies of new 2-methyl quinazolin-4(3h)-ones derivatives. The Eurasia Proceedings of Science, Technology, Engineering & Mathematics (EPSTEM), 28, 519-525.
UR  - https://doi.org/10.55549/epstem.1523874
L1  - https://dergipark.org.tr/en/download/article-file/4104379
ER  -