Synthesis, Crystal Structure, Hirshfeld Surface Analysis and Biological Activity of 1-(Bis(4-methoxyphenyl)-methyl)-4-(2-(2-methylphenoxy)ethyl)piperazine

Synthesis, Crystal Structure, Hirshfeld Surface Analysis and Biological Activity of 1-(Bis(4-methoxyphenyl)-methyl)-4-(2-(2-methylphenoxy)ethyl)piperazine

论文摘要

In this study, a novel phenoxyethylamine derivative 1-(bis(4-methoxy phenyl)-methyl)-4-(2-(2-methylphenoxy)ethyl)piperazine(C28 H35 N2 O3, Mr = 454.58) has been synthesized and its structure was characterized by 1 H NMR, 13 C NMR, HRMS and single-crystal X-ray diffraction. The compound crystallizes in triclinic system, space group P1 with a = 6.1980(12),b = 12.212(2), c = 19.527(4) ?, α = 93.08(3)°, β = 98.62(3)°, γ = 90.72(3)°, V = 1458.9(5) ?3, Z =2, Dc = 1.035 g/cm3, F(000) = 489, μ = 0.067 mm-1, Mo Kα radiation(λ = 0.71073 ?), the final R= 0.0693 and wR = 0.1759 for 3030 observed reflections with I > 2σ(I). The bioassay results indicated that the title compound 5 displayed effective activities against glutamine-induced neurotoxicity in PC12 cells.

论文目录

  • 1 INTRODUCTION
  • 2 EXPERIMENTAL
  •   2.1 Materials and apparatuses
  •   2.2 Synthesis
  •   2.3 X-ray crystal structure determination
  •   2.4 Hirshfeld surfaces analysis
  •   2.5 Biological activity
  • 3 RESULTS AND DISCUSSION
  •   3.1 Crystal structure of compound 5
  •   3.2 Hirshfeld surfaces analysis
  •   3.3 Biological activity
  • 文章来源

    类型: 期刊论文

    作者: 仲琰,朱义杰,高雅蓉,许逸,李萍,吴斌

    来源: Chinese Journal of Structural Chemistry 2019年07期

    年度: 2019

    分类: 工程科技Ⅰ辑

    专业: 化学,有机化工

    单位: School of Chemistry and Chemical Engineering, Southeast University,School of Pharmacy, Nanjing Medical University,School of Basic Medical Sciences, Nanjing Medical University

    基金: Supported by the National Natural Science Foundation of China(No.81371451),the Natural Science Foundation of Jiangsu Province(No.BK20131390,BK20151444)

    分类号: O626;TQ460.1

    DOI: 10.14102/j.cnki.0254-5861.2011-2345

    页码: 1093-1098

    总页数: 6

    文件大小: 404K

    下载量: 14

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    Synthesis, Crystal Structure, Hirshfeld Surface Analysis and Biological Activity of 1-(Bis(4-methoxyphenyl)-methyl)-4-(2-(2-methylphenoxy)ethyl)piperazine
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