1-((E)-3-(4-((thiophen-2-ylmethylimino)methyl)phenyl)acryloyl)anthracene-9,10-dione

• 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-((E)-3-(4-((thiophen-2-ylmethylimino)methyl)phenyl)acryloyl)anthracene-9,10-dione
• 英文别名: 1-[(E)-3-[4-(thiophen-2-ylmethyliminomethyl)phenyl]prop-2-enoyl]anthracene-9,10-dione
• 化学式: C₂₉H₁₉NO₃S
• 分子量: 461.541
• InChiKey: VOLHENWLTVOQCR-FSBHQYJDSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.6
• 重原子数：
  34
• 可旋转键数：
  6
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.03
• 拓扑面积：
  91.8
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  1-(蒽-1-基)乙酮 在 溶剂黄146 、 sodium hydroxide 作用下， 以 1,4-二氧六环 、 甲醇 、 水 为溶剂， 反应 17.08h， 生成 1-((E)-3-(4-((thiophen-2-ylmethylimino)methyl)phenyl)acryloyl)anthracene-9,10-dione
  参考文献：
  名称：

  Novel anthraquinone based chalcone analogues containing an imine fragment: Synthesis, cytotoxicity and anti-angiogenic activity

  摘要：

  A new class of imine derivatives of hybrid chalcone analogues containing anthraquinone scaffold was synthesized and evaluated for their in vitro cytotoxic activity against HeLa, LS174, and A549 cancer cells. The compound 5n with furan ring linked to imino group showed potent activity against all target cells with IC50 values ranging from 1.76 to 6.11 mu M. A mode of action study suggested that compounds induced changes typical for apoptosis in HeLa cells. The most active compounds inhibited tubulogenesis and 5h was found to exhibit a strong anti-angiogenic effect. (C) 2013 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2013.11.075

文献信息

• Novel anthraquinone based chalcone analogues containing an imine fragment: Synthesis, cytotoxicity and anti-angiogenic activity
  作者：Branka Kolundžija、Violeta Marković、Tatjana Stanojković、Ljubinka Joksović、Ivana Matić、Nina Todorović、Marijana Nikolić、Milan D. Joksović

  DOI：10.1016/j.bmcl.2013.11.075

  日期：2014.1

  A new class of imine derivatives of hybrid chalcone analogues containing anthraquinone scaffold was synthesized and evaluated for their in vitro cytotoxic activity against HeLa, LS174, and A549 cancer cells. The compound 5n with furan ring linked to imino group showed potent activity against all target cells with IC50 values ranging from 1.76 to 6.11 mu M. A mode of action study suggested that compounds induced changes typical for apoptosis in HeLa cells. The most active compounds inhibited tubulogenesis and 5h was found to exhibit a strong anti-angiogenic effect. (C) 2013 Elsevier Ltd. All rights reserved.