Synthesis, crystal structure, Hirshfeld surface analysis, DFT, molecular docking and molecular dynamic simulation studies of (E)-2,6-bis(4-chlorophenyl)-3-methyl-4-(2-(2,4,6-trichlorophenyl)hydrazono)piperidine derivatives

被引：0
|
作者：
Anthony, L. Athishu [1 ]
Rajaraman, D. [1 ]
Sundararajan, G. [2 ]
Suresh, M. [3 ]
Nethaji, P. [4 ]
Jaganathan, R. [5 ]
Poomani, Kumaradhas [5 ]
机构：
[1] Department of Chemistry, St Joseph University, Nagaland, Dimapur,797 115, India
[2] Department of Chemistry, Thanthai Hans Roever College (Autonomous), Tamil Nadu, Perambalur,621220, India
[3] Department of Chemistry, AVS Arts and Science College, Tamil Nadu, Salem,603 110, India
[4] Department of Chemical Engineering, Sri Sivasubramaniya Nadar College of Engineering, Tamil Nadu, 603 110, India
[5] Laboratory of Biocrystallography and Computational Molecular Biology, Department of Physics, Periyar University, Salem, India
来源：
Journal of Molecular Structure | 2022年 / 1266卷
关键词：
59;
D O I：
暂无
中图分类号：
学科分类号：
摘要：
引用
收藏
相关论文
共 50 条
  • [21] Crystal and Molecular Structure Analysis of 1-Acryloyl-3-methyl-2,6-bis(3,4,5-trimethoxyphenyl)piperidine-4-one
    Gnanendra, C. R.
    Lakshminarayana, B. N.
    Thippeswamy, G. B.
    Sridhar, M. A.
    Naik, Nagaraja
    Prasad, J. Shashidhara
    MOLECULAR CRYSTALS AND LIQUID CRYSTALS, 2009, 515 : 179 - 189
  • [22] Crystal structure and Hirshfeld surface analysis of 2-(4-chlorophenyl)-4-(dimethoxymethyl)-5-phenyl-1,3-thiazole
    Guseinov, Firudin, I
    Kobrakov, Konstantin, I
    Shuvalova, Elena, V
    Tuzharov, Egor, I
    Akkurt, Mehmet
    Yildirim, Sema Ozturk
    Bhattarai, Ajaya
    ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2022, 78 : 675 - +
  • [23] Synthesis, crystal structure, DFT calculations and Hirshfeld surface analysis of 3-butyl-2,6-bis(4-fluorophenyl)piperidin-4-one
    Anitha, K.
    Sivakumar, S.
    Arulraj, R.
    Rajkumar, K.
    Kaur, Manpreet
    Jasinski, Jerry P.
    ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2020, 76 : 651 - +
  • [24] Synthesis, molecular docking and molecular dynamic simulation studies of 2-chloro-5-[(4-chlorophenyl)sulfamoyl]-N-(alkyl/aryl)-4-nitrobenzamide derivatives as antidiabetic agents
    Thakral, Samridhi
    Narang, Rakesh
    Kumar, Manoj
    Singh, Vikramjeet
    BMC CHEMISTRY, 2020, 14 (01)
  • [25] Synthesis, molecular docking and molecular dynamic simulation studies of 2-chloro-5-[(4-chlorophenyl)sulfamoyl]-N-(alkyl/aryl)-4-nitrobenzamide derivatives as antidiabetic agents
    Samridhi Thakral
    Rakesh Narang
    Manoj Kumar
    Vikramjeet Singh
    BMC Chemistry, 14
  • [26] Crystal structure, Hirshfeld surface analysis, and DFT and molecular docking studies of 6-cyanonaphthalen-2-yl 4-(benzyloxy)benzoate
    Kumar, Mahadevaiah Harish
    Kumar, Shivakumar Santhosh
    Devarajegowda, Hirehalli Chikkegowda
    Srinivasa, Hosapalya Thimmaiah
    Palakshamurthy, Bandrehalli Siddagangaiah
    ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2024, 80 : 1180 - +
  • [27] Crystal Structure and Conformation Study of 3-Methyl-2, 6-bis (4-chlorophenyl) Piperidin-4-one Thiosemicarbazone Derivative
    Sampath, N.
    Mathews, Rita
    Ponnuswamy, M. N.
    JOURNAL OF CHEMICAL CRYSTALLOGRAPHY, 2010, 40 (12) : 1099 - 1104
  • [28] Crystal Structure and Conformation Study of 3-Methyl-2, 6-bis (4-chlorophenyl) Piperidin-4-one Thiosemicarbazone Derivative
    N. Sampath
    Rita Mathews
    M. N. Ponnuswamy
    Journal of Chemical Crystallography, 2010, 40 : 1099 - 1104
  • [29] Crystal structure and Hirshfeld surface analysis of 6-((E)-2-{4-[2-(4-chlorophenyl)-2-oxoethoxy]pnen-yl}ethenyl)-4,5-dihyciropyrudazin-3(2H)-one
    Daoui, Said
    Muwafaq, Israa
    Cinar, Emine Berrin
    Abudunia, Abdulmalik
    Dege, Necmi
    Benchat, Noureddine
    Karrouchi, Khalid
    ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2022, 78 : 8 - +
  • [30] 2-[(4-Chlorophenyl)sulfanyl]-2-methoxy-1-phenyl-ethan-1-one: crystal structure and Hirshfeld surface analysis
    Caracelli, Ignez
    Zukerman-Schpector, Julio
    Traesel, Henrique J.
    Olivato, Paulo R.
    Jotani, Mukesh M.
    Tiekink, Edward R. T.
    ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2018, 74 : 703 - +
12345