3,5-bis(4-allyloxybenzylidene)-1-benzylpiperidin-4-one | 1210410-21-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 哌啶类
• 英文名称: 3,5-bis(4-allyloxybenzylidene)-1-benzylpiperidin-4-one
• 英文别名: (3E,5E)-3,5-Bis(4-allyloxybenzylidene)-1-benzylpiperidin-4-one；(3E,5E)-1-benzyl-3,5-bis[(4-prop-2-enoxyphenyl)methylidene]piperidin-4-one
• CAS: 1210410-21-1
• 化学式: C₃₂H₃₁NO₃
• 分子量: 477.603
• InChiKey: HWFLZPXDFXJJOR-IABPKXMJSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.4
• 重原子数：
  36
• 可旋转键数：
  10
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.16
• 拓扑面积：
  38.8
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  N-苄基哌啶酮 、 4-烯丙氧基苯甲醛 在 ammonium acetate 作用下， 以 乙醇 为溶剂， 以91%的产率得到3,5-bis(4-allyloxybenzylidene)-1-benzylpiperidin-4-one
  参考文献：
  名称：

  Synthesis, crystal structure, and anticancer properties of cyclic monocarbonyl analogs of curcumin

  摘要：

  A series of novel indan-2-one and dibenzylidenepiperidin-4-one compounds were synthesized and screened for anticancer activities. The compounds are symmetrical and they have conjugated double bonds. They closely resemble the curcumin analogs which are found to possess anticancer properties. The structure of the compounds was confirmed by single crystal study and wherever the compound is a powder, the structures were confirmed by spectral data (IR, NMR, and Mass).

  DOI：

  10.1007/s00044-009-9284-7

文献信息

• Synthesis, crystal structure, and anticancer properties of cyclic monocarbonyl analogs of curcumin
  作者：Natesan Sundarmurthy Karthikeyan、Kulathu Iyer Sathiyanarayanan、Paduthapillai Gopal Aravindan、P. Giridharan

  DOI：10.1007/s00044-009-9284-7

  日期：2011.1

  A series of novel indan-2-one and dibenzylidenepiperidin-4-one compounds were synthesized and screened for anticancer activities. The compounds are symmetrical and they have conjugated double bonds. They closely resemble the curcumin analogs which are found to possess anticancer properties. The structure of the compounds was confirmed by single crystal study and wherever the compound is a powder, the structures were confirmed by spectral data (IR, NMR, and Mass).