10-(3-diisopropylamino-2-hydroxypropyl)-10H-acridin-9-one | 1156489-79-0

• 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: 10-(3-diisopropylamino-2-hydroxypropyl)-10H-acridin-9-one
• 英文别名: 10-[3-[Di(propan-2-yl)amino]-2-hydroxypropyl]acridin-9-one
• CAS: 1156489-79-0
• 化学式: C₂₂H₂₈N₂O₂
• 分子量: 352.477
• InChiKey: MDRUDNDNKKHVDJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.1
• 重原子数：
  26
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.41
• 拓扑面积：
  43.8
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  10-(环氧乙烷-2-基甲基)吖啶-9(10H)-酮 、 二异丙胺 反应 0.08h， 以74%的产率得到10-(3-diisopropylamino-2-hydroxypropyl)-10H-acridin-9-one
  参考文献：
  名称：

  Search for MDR modulators: Design, syntheses and evaluations of N-substituted acridones for interactions with p-glycoprotein and Mg2+

  摘要：

  By combining the structural features of acridone based anti-cancer drugs (like amsacrine) and MDR modulator propafenone, acridones with hydroxyl amine chain at N-10 have been designed and synthesized. These molecules exhibit appreciable interactions with p-gp and Mg2+ indicating their suitability to modulate p-gp mediated multi drug resistance. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2009.02.002

文献信息

• Search for MDR modulators: Design, syntheses and evaluations of N-substituted acridones for interactions with p-glycoprotein and Mg2+
  作者：Palwinder Singh、Jatinder kaur、Prabhjit Kaur、Satwinderjeet Kaur

  DOI：10.1016/j.bmc.2009.02.002

  日期：2009.3

  By combining the structural features of acridone based anti-cancer drugs (like amsacrine) and MDR modulator propafenone, acridones with hydroxyl amine chain at N-10 have been designed and synthesized. These molecules exhibit appreciable interactions with p-gp and Mg2+ indicating their suitability to modulate p-gp mediated multi drug resistance. (C) 2009 Elsevier Ltd. All rights reserved.