methyl 5-[(2-quinolinylcarbonyl)amino]pentyl methylphosphonate | 1350981-68-8

• 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: methyl 5-[(2-quinolinylcarbonyl)amino]pentyl methylphosphonate
• 英文别名: N-[5-[methoxy(methyl)phosphoryl]oxypentyl]quinoline-2-carboxamide
• CAS: 1350981-68-8
• 化学式: C₁₇H₂₃N₂O₄P
• 分子量: 350.354
• InChiKey: VISLYULCMOFWFZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.1
• 重原子数：
  24
• 可旋转键数：
  9
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.41
• 拓扑面积：
  77.5
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  喹哪啶酸 在 四溴化碳 、 三苯基膦 、 N,N'-羰基二咪唑 作用下， 以 四氢呋喃 、 氯仿 、 乙腈 为溶剂， 反应 40.0h， 生成 methyl 5-[(2-quinolinylcarbonyl)amino]pentyl methylphosphonate
  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.