1-(3-Trifluoromethylphenyl)-3-(4-pyridinyl)-2-propene-1-one

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 1-(3-Trifluoromethylphenyl)-3-(4-pyridinyl)-2-propene-1-one
• 英文别名: (E)-3-pyridin-4-yl-1-[3-(trifluoromethyl)phenyl]prop-2-en-1-one
• 化学式: C₁₅H₁₀F₃NO
• 分子量: 277.246
• InChiKey: ATFFPIWVJYDKGY-SNAWJCMRSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.5
• 重原子数：
  20
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  30
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  4-吡啶甲醛 、 间三氟甲基苯乙酮 在 2,2'-联吡啶 、 cobalt(II) acetate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 20.0h， 生成 1-(3-Trifluoromethylphenyl)-3-(4-pyridinyl)-2-propene-1-one
  参考文献：
  名称：

  Inhibition of Myeloperoxidase Release from Rat Polymorphonuclear Leukocytes by a Series of Azachalcone Derivatives

  摘要：

  A series of azachalcones was evaluated for ability to affect secretion of myeloperoxidase by rat polymorphonuclear leukocytes stimulated by fMLP. The compounds were found to interfere with cellular uptake of extracellular calcium. Structure-activity relationships are discussed.

  DOI：

  10.1021/jm00051a013

文献信息

• Calcium uptake inhibitors
  申请人：Merrell Pharmaceuticals Inc.

  公开号：US05500429A1

  公开（公告）日：1996-03-19

  This invention relates to 1-aryl-3-pyridinyl-2-propene-1-ones, the use of these compounds as calcium uptake inhibitors in leukocytes and thrombocytes, and pharmaceutical compositions containing these compounds as active ingredients, and the process of their preparation.

  这项发明涉及1-芳基-3-吡啶基-2-丙烯-1-酮，以及这些化合物在白细胞和血小板中作为钙摄取抑制剂的用途，以及含有这些化合物作为活性成分的药物组合物，以及它们的制备过程。
• US5500429A
  申请人：——

  公开号：US5500429A

  公开（公告）日：1996-03-19
• Inhibition of Myeloperoxidase Release from Rat Polymorphonuclear Leukocytes by a Series of Azachalcone Derivatives
  作者：Michael L. Edwards、David M. Stemerick、Jeffrey S. Sabol、Keith A. Diekema、Robert J. Dinerstein

  DOI：10.1021/jm00051a013

  日期：1994.12

  A series of azachalcones was evaluated for ability to affect secretion of myeloperoxidase by rat polymorphonuclear leukocytes stimulated by fMLP. The compounds were found to interfere with cellular uptake of extracellular calcium. Structure-activity relationships are discussed.