2-dimethylaminomethyl-6-methoxy-4-(pyridin-2-yl)-2H-phtalazin-1-one

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪类
• 英文名称: 2-dimethylaminomethyl-6-methoxy-4-(pyridin-2-yl)-2H-phtalazin-1-one
• 英文别名: 2-[(Dimethylamino)methyl]-6-methoxy-4-pyridin-2-ylphthalazin-1-one
• 化学式: C₁₇H₁₈N₄O₂
• 分子量: 310.356
• InChiKey: AJBUMSREODNGBK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.2
• 重原子数：
  23
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.24
• 拓扑面积：
  58
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  3-hydroxy-3-(pyridin-2-yl)-5-methoxy-2-phenyl-2,3-dihydro-1H-isoindol-1-one 在 一水合肼 作用下， 以 甲醇 、 丙醇 、 水 为溶剂， 反应 47.5h， 生成 2-dimethylaminomethyl-6-methoxy-4-(pyridin-2-yl)-2H-phtalazin-1-one
  参考文献：
  名称：

  A Practical Approach for Preparation of 2‐[(Dialkylamino)‐methyl]‐4‐aryl‐2H‐phthalazin‐1‐ones via Mannich Reaction of 4‐Aryl‐2H‐phthalazin‐1‐ones

  摘要：

  Synthesis of 4-aryl-2H-phthalazin-1-ones 5 and their successive conversion, via the Mannich reaction into 2-[(dialkylamino)-methyl]-4-aryl-2H-phthalazin-1-ones 6, 7, 8, 9 as a way of regiospecific transformation of the 4-methoxybenzanilide 1, is described. In addition, the compounds 5b and 7 appeared to be effective complexing ligands for such metal as Cu(II), Ni(II), Fe(II), and Fe(III).

  DOI：

  10.1081/scc-200048404

文献信息

• A Practical Approach for Preparation of 2‐[(Dialkylamino)‐methyl]‐4‐aryl‐2<i>H</i>‐phthalazin‐1‐ones via Mannich Reaction of 4‐Aryl‐2<i>H</i>‐phthalazin‐1‐ones
  作者：Jan Epsztajn、Zbigniew Malinowski、Paweł Urbaniak、Grzegorz Andrijewski

  DOI：10.1081/scc-200048404

  日期：2005.1

  Synthesis of 4-aryl-2H-phthalazin-1-ones 5 and their successive conversion, via the Mannich reaction into 2-[(dialkylamino)-methyl]-4-aryl-2H-phthalazin-1-ones 6, 7, 8, 9 as a way of regiospecific transformation of the 4-methoxybenzanilide 1, is described. In addition, the compounds 5b and 7 appeared to be effective complexing ligands for such metal as Cu(II), Ni(II), Fe(II), and Fe(III).