1-(2,4-dihydroxyphenyl)-3-(2,5-dioxabicyclo[4.4.0]deca-6,8,10-trien-8-yl)prop-2-en-1-one | 86301-67-9

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 直链 1,3-二芳基丙烷
• 英文名称: 1-(2,4-dihydroxyphenyl)-3-(2,5-dioxabicyclo[4.4.0]deca-6,8,10-trien-8-yl)prop-2-en-1-one
• 英文别名: 3-(2,3-Dihydro-1,4-benzodioxin-6-yl)-1-(2,4-dihydroxyphenyl)prop-2-en-1-one
• CAS: 86301-67-9
• 化学式: C₁₇H₁₄O₅
• 分子量: 298.295
• InChiKey: MZVRJKHSDWQUAT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.2
• 重原子数：
  22
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  76
• 氢给体数：
  2
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  1-(2,4-dihydroxyphenyl)-3-(2,5-dioxabicyclo[4.4.0]deca-6,8,10-trien-8-yl)prop-2-en-1-one 在 一水合肼 、 溶剂黄146 作用下， 以 乙醇 为溶剂， 以63%的产率得到5-(2,3-dihydro-1,4-benzodioxane-6-yl)-3-(2,4-dihydroxyphenyl)-4,5-dihydro-1H-pyrazole
  参考文献：
  名称：

  Synthesis and antihepatotoxic activity of 5-(2,3-dihydro-1,4-benzodioxane-6-yl)-3-substituted-phenyl-4,5-dihydro-1H-pyrazole derivatives

  摘要：

  In continuance of our search for newer antihepatotoxic agents some novel pyrazoline derivatives containing 1,4-dioxane ring system were synthesized starting from 3-(2,3-dihydro-1,4-benzodioxane-6-yl)-1-substituted-phenylprop-2-en-1-one. Some of the synthesized compounds were evaluated for antihepatotoxic activity against CCl4-induced hepatotoxicity in rats. Among them some compounds have shown significant antihepatotoxic activity comparable to standard drug silymarin. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2011.10.056
• 作为产物：
  描述：

  3,4-二羟基苯甲醛 在 potassium carbonate 、 potassium hydroxide 作用下， 以 乙醇 、 水 、 丙酮 为溶剂， 反应 25.0h， 生成 1-(2,4-dihydroxyphenyl)-3-(2,5-dioxabicyclo[4.4.0]deca-6,8,10-trien-8-yl)prop-2-en-1-one
  参考文献：
  名称：

  Synthesis and antihepatotoxic activity of 5-(2,3-dihydro-1,4-benzodioxane-6-yl)-3-substituted-phenyl-4,5-dihydro-1H-pyrazole derivatives

  摘要：

  In continuance of our search for newer antihepatotoxic agents some novel pyrazoline derivatives containing 1,4-dioxane ring system were synthesized starting from 3-(2,3-dihydro-1,4-benzodioxane-6-yl)-1-substituted-phenylprop-2-en-1-one. Some of the synthesized compounds were evaluated for antihepatotoxic activity against CCl4-induced hepatotoxicity in rats. Among them some compounds have shown significant antihepatotoxic activity comparable to standard drug silymarin. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2011.10.056

文献信息

• Synthesis and antihepatotoxic activity of 5-(2,3-dihydro-1,4-benzodioxane-6-yl)-3-substituted-phenyl-4,5-dihydro-1H-pyrazole derivatives
  作者：Habibullah Khalilullah、Shamshir Khan、Mohamed Jawed Ahsan、Bahar Ahmed

  DOI：10.1016/j.bmcl.2011.10.056

  日期：2011.12

  In continuance of our search for newer antihepatotoxic agents some novel pyrazoline derivatives containing 1,4-dioxane ring system were synthesized starting from 3-(2,3-dihydro-1,4-benzodioxane-6-yl)-1-substituted-phenylprop-2-en-1-one. Some of the synthesized compounds were evaluated for antihepatotoxic activity against CCl4-induced hepatotoxicity in rats. Among them some compounds have shown significant antihepatotoxic activity comparable to standard drug silymarin. (C) 2011 Elsevier Ltd. All rights reserved.