6-isopropylfuro[3,4-c]furan-1(3H)-one | 1402592-05-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 呋喃
• 英文名称: 6-isopropylfuro[3,4-c]furan-1(3H)-one
• CAS: 1402592-05-5
• 化学式: C₉H₁₀O₃
• 分子量: 166.177
• InChiKey: VLPNRSJIXPZJFX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.07
• 重原子数：
  12.0
• 可旋转键数：
  1.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.44
• 拓扑面积：
  39.44
• 氢给体数：
  0.0
• 氢受体数：
  3.0

反应信息

• 作为反应物：
  描述：

  6-isopropylfuro[3,4-c]furan-1(3H)-one 在 偶氮二甲酸二异丙酯 、 三苯基膦 作用下， 以 二氯甲烷 为溶剂， 生成
  参考文献：
  名称：

  Novel heterocyclic scaffolds of GW4064 as farnesoid X receptor agonists

  摘要：

  The farnesoid X receptor (FXR) may play a crucial role in a number of metabolic diseases and, as such, could potentially serve as a target for the development of therapeutics as a treatment for those diseases. Previous work has described GW4064 as an FXR agonist with an interesting activity profile. This manuscript will describe the synthesis of novel analogs of GW4064 and the activity profile of those analogs. (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2014.11.050
• 作为产物：
  描述：

  在 辛酸铑 、 4-乙酰氨基苯磺酰叠氮 、 三乙胺 作用下， 以 乙腈 、 苯 为溶剂， 生成 6-isopropylfuro[3,4-c]furan-1(3H)-one
  参考文献：
  名称：

  Novel heterocyclic scaffolds of GW4064 as farnesoid X receptor agonists

  摘要：

  The farnesoid X receptor (FXR) may play a crucial role in a number of metabolic diseases and, as such, could potentially serve as a target for the development of therapeutics as a treatment for those diseases. Previous work has described GW4064 as an FXR agonist with an interesting activity profile. This manuscript will describe the synthesis of novel analogs of GW4064 and the activity profile of those analogs. (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2014.11.050

文献信息

• Gold-Catalyzed Synthesis of Furans and Furanones from Sulfur Ylides
  作者：Xueliang Huang、Bo Peng、Marco Luparia、Luis F. R. Gomes、Luís F. Veiros、Nuno Maulide

  DOI：10.1002/anie.201203637

  日期：2012.8.27

  A golden switch: Doubly stabilized sulfonium ylides can be coupled with alkynes in a gold‐catalyzed synthesis of heterocycles. This method hinges on a switch in the reactivity of the sulfur ylide resulting from the simple modification of the electron‐withdrawing moieties and leads to either furans or furanones bearing a quaternary center (see scheme).

  金色开关：双稳定锍叶立德可以与在杂环的一个金催化合成炔烃。在从吸电子部分和引线要么呋喃或呋喃酮轴承季中心的简单修改而产生的硫叶立德反应性的开关有关此方法的铰链（参见方案）。