N-{6-[(methylsulfonyl)amino]-6-oxohexyl}-2-quinolinecarboxamide | 1350981-74-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: N-{6-[(methylsulfonyl)amino]-6-oxohexyl}-2-quinolinecarboxamide
• 英文别名: N-[6-(methanesulfonamido)-6-oxohexyl]quinoline-2-carboxamide
• CAS: 1350981-74-6
• 化学式: C₁₇H₂₁N₃O₄S
• 分子量: 363.437
• InChiKey: FYILHCNVKFUTMV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  25
• 可旋转键数：
  8
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.35
• 拓扑面积：
  114
• 氢给体数：
  2
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  (6-甲氧基-6-氧代己基)胺 在 N,N'-羰基二咪唑 、 sodium hydroxide 作用下， 以 四氢呋喃 、 乙醇 、 N,N-二甲基甲酰胺 为溶剂， 反应 7.25h， 生成 N-{6-[(methylsulfonyl)amino]-6-oxohexyl}-2-quinolinecarboxamide
  参考文献：
  名称：

  Synthesis of 2-quinolinecarboxamide derivatives as potential HDAC inhibitors

  摘要：

  Inhibition of histone deacetylase activity appears as an original and effective approach for the treatment of cancer. A series of novel quinoline-containing derivatives has been synthesized and found that some of these compounds possess nanomolar histone deacetylase inhibitory activity.

  DOI：

  10.1007/s10593-011-0825-x

文献信息

• Synthesis of 2-quinolinecarboxamide derivatives as potential HDAC inhibitors
  作者：O. Habarova、O. Bobiļeva、E. Loža、N. Romančikova

  DOI：10.1007/s10593-011-0825-x

  日期：2011.9

  Inhibition of histone deacetylase activity appears as an original and effective approach for the treatment of cancer. A series of novel quinoline-containing derivatives has been synthesized and found that some of these compounds possess nanomolar histone deacetylase inhibitory activity.