3-(2'-furyl)naphthalic anhydride | 688043-89-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 3-(2'-furyl)naphthalic anhydride
• 英文别名: 7-(Furan-2-yl)-3-oxatricyclo[7.3.1.05,13]trideca-1(12),5(13),6,8,10-pentaene-2,4-dione
• CAS: 688043-89-2
• 化学式: C₁₆H₈O₄
• 分子量: 264.237
• InChiKey: QNZFCVXSARTXQJ-UHFFFAOYSA-N

物化性质

• 熔点：
  188-190 °C
• 沸点：
  493.7±33.0 °C(Predicted)
• 密度：
  1.430±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.3
• 重原子数：
  20
• 可旋转键数：
  1
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  56.5
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  N,N-二甲基乙二胺 、 3-(2'-furyl)naphthalic anhydride 以 氯仿 为溶剂， 反应 24.0h， 以87%的产率得到2-(2-dimethylamino-ethyl)-5-furan-2-yl-benzo[de]isoquinoline-1,3-dione
  参考文献：
  名称：

  Synthesis, Biological Activity, and Quantitative Structure−Activity Relationship Study of Azanaphthalimide and Arylnaphthalimide Derivatives

  摘要：

  A series of quinoline derivatives as aza analogues of the naphthalene chromophore and a series of "nonfused" tricyclic aromatic systems, in particular 5-arylquinolines and 5- or 6-aryl and heteroaryl naphthalene systems, were synthesized and evaluated for growth-inhibitory properties in several human cell lines. The analysis of quantitative structure-antitumor activity relationships for the growth-inhibitory properties is also reported. Findings suggest that these compounds may not express their cytotoxicity via interaction on DNA.

  DOI：

  10.1021/jm0310784
• 作为产物：
  描述：

  3-溴-1,8-萘二甲酸酐 、 2-(三丁基锡烷基)呋喃 在 四(三苯基膦)钯 作用下， 以 1,4-二氧六环 为溶剂， 反应 48.0h， 以80%的产率得到3-(2'-furyl)naphthalic anhydride
  参考文献：
  名称：

  Synthesis, Biological Activity, and Quantitative Structure−Activity Relationship Study of Azanaphthalimide and Arylnaphthalimide Derivatives

  摘要：

  A series of quinoline derivatives as aza analogues of the naphthalene chromophore and a series of "nonfused" tricyclic aromatic systems, in particular 5-arylquinolines and 5- or 6-aryl and heteroaryl naphthalene systems, were synthesized and evaluated for growth-inhibitory properties in several human cell lines. The analysis of quantitative structure-antitumor activity relationships for the growth-inhibitory properties is also reported. Findings suggest that these compounds may not express their cytotoxicity via interaction on DNA.

  DOI：

  10.1021/jm0310784