3-(4-氯苯基氨基甲酰)-2,4-二氟联苯-4-苯甲酸 | 1095208-60-8

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 缩酚酸和缩酚酸环醚类
• 中文名称: 3-(4-氯苯基氨基甲酰)-2,4-二氟联苯-4-苯甲酸
• 英文名称: 3-[(4-Chlorophenyl)carbamoyl]-2',4'-difluoro[1,1'-biphenyl]-4-yl benzoate
• 英文别名: [2-[(4-chlorophenyl)carbamoyl]-4-(2,4-difluorophenyl)phenyl] benzoate
• CAS: 1095208-60-8
• 化学式: C₂₆H₁₆ClF₂NO₃
• 分子量: 463.868
• InChiKey: UBFUXHJLOGHVTK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.6
• 重原子数：
  33
• 可旋转键数：
  6
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  55.4
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  3-(chlorocarbonyl)-2',4'-difluoro-[1,1'-biphenyl]-4-yl benzoate 、 对氯苯胺 以 二氯甲烷 为溶剂， 生成 3-(4-氯苯基氨基甲酰)-2,4-二氟联苯-4-苯甲酸
  参考文献：
  名称：

  Synthesis and biological evaluation of amide derivatives of diflunisal as potential anti-tumor agents

  摘要：

  To discover the new medicinal activity, the structure of diflunisal has been modified. Forty amide derivatives of diflunisal were synthesized starting from diflunisal in three steps. Their inhibition growth rate of human lung cancer cell (A549) and human endometrial adenocarcinoma cell (Ishikawa) in vitro was evaluated. The preliminary assay results showed that compounds 6j, 7o and 8c exhibited good anti-tumor activities and excellent selectivity for the Ishikawa cell, may be potential anti-tumor agents. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2009.05.082

文献信息

• Synthesis and biological evaluation of amide derivatives of diflunisal as potential anti-tumor agents
  作者：Guang-Xiang Zhong、Lu-Lu Chen、Hai-Bo Li、Fu-Jin Liu、Jin-Qing Hu、Wei-Xiao Hu

  DOI：10.1016/j.bmcl.2009.05.082

  日期：2009.8

  To discover the new medicinal activity, the structure of diflunisal has been modified. Forty amide derivatives of diflunisal were synthesized starting from diflunisal in three steps. Their inhibition growth rate of human lung cancer cell (A549) and human endometrial adenocarcinoma cell (Ishikawa) in vitro was evaluated. The preliminary assay results showed that compounds 6j, 7o and 8c exhibited good anti-tumor activities and excellent selectivity for the Ishikawa cell, may be potential anti-tumor agents. (C) 2009 Elsevier Ltd. All rights reserved.