Ramasamy Uthayamalar, Narayanasamy Nivetha, G. Ayyannan
{"title":"一种新型吡唑酮希夫碱的合成、表征、分子对接及抗氧化研究","authors":"Ramasamy Uthayamalar, Narayanasamy Nivetha, G. Ayyannan","doi":"10.36686/ariviyal.cser.2019.01.01.004","DOIUrl":null,"url":null,"abstract":"Ariviyal Publishing Journals ISSN: 2582-3353 Abstract: A novel hetero atom containing Schiff base (NCQ) is synthesized by reacting 4-amino antipyrine with 2Chloro-benzo[h]quinoline-3-carbaldehyde and the ligand was characterized using elemental analysis ultraviolet–visible spectroscopy (UV-vis), Fourier-transform infrared spectroscopy (FT-IR), 1H and 13C nuclear magnetic resonance spectroscopy (NMR). The molecular structure of the ligand was confirmed by single crystal X-ray diffraction studies. The synthesized compound has adopted a monoclinic crystal system with P21/n space group. Molecular docking studies were carried out for the synthesized compound (NCQ) in order to analyze its binding affinity towards cancer proteins 1DTO and 1JNX. The NCQ compound showed excellent interactions with cancer proteins 1DTO and 1JNX.","PeriodicalId":9833,"journal":{"name":"Chemical Science and Engineering Research","volume":null,"pages":null},"PeriodicalIF":0.0000,"publicationDate":"2019-08-30","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"1","resultStr":"{\"title\":\"A New Pyrazolone Schiff Base: Synthesis, Characterization and Molecular Docking and Antioxidant Studies\",\"authors\":\"Ramasamy Uthayamalar, Narayanasamy Nivetha, G. Ayyannan\",\"doi\":\"10.36686/ariviyal.cser.2019.01.01.004\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"Ariviyal Publishing Journals ISSN: 2582-3353 Abstract: A novel hetero atom containing Schiff base (NCQ) is synthesized by reacting 4-amino antipyrine with 2Chloro-benzo[h]quinoline-3-carbaldehyde and the ligand was characterized using elemental analysis ultraviolet–visible spectroscopy (UV-vis), Fourier-transform infrared spectroscopy (FT-IR), 1H and 13C nuclear magnetic resonance spectroscopy (NMR). The molecular structure of the ligand was confirmed by single crystal X-ray diffraction studies. The synthesized compound has adopted a monoclinic crystal system with P21/n space group. Molecular docking studies were carried out for the synthesized compound (NCQ) in order to analyze its binding affinity towards cancer proteins 1DTO and 1JNX. The NCQ compound showed excellent interactions with cancer proteins 1DTO and 1JNX.\",\"PeriodicalId\":9833,\"journal\":{\"name\":\"Chemical Science and Engineering Research\",\"volume\":null,\"pages\":null},\"PeriodicalIF\":0.0000,\"publicationDate\":\"2019-08-30\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"1\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Chemical Science and Engineering Research\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://doi.org/10.36686/ariviyal.cser.2019.01.01.004\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Chemical Science and Engineering Research","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.36686/ariviyal.cser.2019.01.01.004","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
A New Pyrazolone Schiff Base: Synthesis, Characterization and Molecular Docking and Antioxidant Studies
Ariviyal Publishing Journals ISSN: 2582-3353 Abstract: A novel hetero atom containing Schiff base (NCQ) is synthesized by reacting 4-amino antipyrine with 2Chloro-benzo[h]quinoline-3-carbaldehyde and the ligand was characterized using elemental analysis ultraviolet–visible spectroscopy (UV-vis), Fourier-transform infrared spectroscopy (FT-IR), 1H and 13C nuclear magnetic resonance spectroscopy (NMR). The molecular structure of the ligand was confirmed by single crystal X-ray diffraction studies. The synthesized compound has adopted a monoclinic crystal system with P21/n space group. Molecular docking studies were carried out for the synthesized compound (NCQ) in order to analyze its binding affinity towards cancer proteins 1DTO and 1JNX. The NCQ compound showed excellent interactions with cancer proteins 1DTO and 1JNX.
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