acridin-4-ylmethyl 4-methanesulfonylamino-2-methoxybenzoate

• 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: acridin-4-ylmethyl 4-methanesulfonylamino-2-methoxybenzoate
• 英文别名: Acridin-4-ylmethyl 4-(methanesulfonamido)-2-methoxybenzoate
• 化学式: C₂₃H₂₀N₂O₅S
• 分子量: 436.488
• InChiKey: AMNNYTRFEYFGIB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  31
• 可旋转键数：
  7
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.13
• 拓扑面积：
  103
• 氢给体数：
  1
• 氢受体数：
  7

反应信息

• 作为产物：
  描述：

  2-甲氧基-4-氨基苯甲酸甲酯 在 吡啶 、 4-二甲氨基吡啶 、 lithium hydroxide 、 N,N'-二环己基碳二亚胺 作用下， 以 四氢呋喃 、 氯仿 、 水 、 丙酮 为溶剂， 反应 77.0h， 生成 acridin-4-ylmethyl 4-methanesulfonylamino-2-methoxybenzoate
  参考文献：
  名称：

  Synthesis and Crystallographic Studies of New Acridinic Esters and Amides: An Efficient Synthetic Route to 4-Methyl Functionalized Acridines

  摘要：

  In order to open a new way in antitumor drugs research, an efficient synthetic route to mono functional 4-substitued acridine derivatives has been developed on the basis of direct electrophilic substitution of acridine. This method leads to a wide range of simple acridinic patterns that can be linked to various side chains. We present here the synthesis of two new families of acridine ester and amide derivatives, obtained from acridinic alcohol and amine respectively, with high yields. Some crystallographic aspects of one representative compound of each family are discussed.

  DOI：

  10.3987/com-03-9778

文献信息

• Synthesis and Crystallographic Studies of New Acridinic Esters and Amides: An Efficient Synthetic Route to 4-Methyl Functionalized Acridines
  作者：Julien Chiron、Jean-Pierre Galy

  DOI：10.3987/com-03-9778

  日期：——

  In order to open a new way in antitumor drugs research, an efficient synthetic route to mono functional 4-substitued acridine derivatives has been developed on the basis of direct electrophilic substitution of acridine. This method leads to a wide range of simple acridinic patterns that can be linked to various side chains. We present here the synthesis of two new families of acridine ester and amide derivatives, obtained from acridinic alcohol and amine respectively, with high yields. Some crystallographic aspects of one representative compound of each family are discussed.