3-(2-aminophenyl)isoquinoline | 185950-67-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 3-(2-aminophenyl)isoquinoline
• 英文别名: 2-Isoquinolin-3-ylaniline；2-isoquinolin-3-ylaniline
• CAS: 185950-67-8
• 化学式: C₁₅H₁₂N₂
• 分子量: 220.274
• InChiKey: AOFNASSGLGQXEL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.1
• 重原子数：
  17
• 可旋转键数：
  1
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  38.9
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  3-(2-aminophenyl)isoquinoline 在 盐酸 、 sodium azide 、 sodium acetate 、 sodium nitrite 作用下， 生成 3-(2-azidophenyl)isoquinoline
  参考文献：
  名称：

  Synthesis of novel ellipticine analogues and their inhibition of Moloney leukaemia reverse transcriptase

  摘要：

  Two new ellipticine analogues were synthetized as potential non nucleoside inhibitors of reverse transcriptase and were tested on Moloney leukaemia virus reverse transcriptase in vitro. Both derivatives (9a,b) showed considerable inhibitory effect; ID50 was found to be in the range of 2.8 to 4.5 x 10(-5) M. \ Copyright (C) 1996 Elsevier Science Ltd

  DOI：

  10.1016/s0960-894x(96)00521-5
• 作为产物：
  描述：

  3-羟基异喹啉 在 四(三苯基膦)钯 吡啶 、 硫酸 、 sodium carbonate 作用下， 反应 6.33h， 生成 3-(2-aminophenyl)isoquinoline
  参考文献：
  名称：

  Synthesis of novel ellipticine analogues and their inhibition of Moloney leukaemia reverse transcriptase

  摘要：

  Two new ellipticine analogues were synthetized as potential non nucleoside inhibitors of reverse transcriptase and were tested on Moloney leukaemia virus reverse transcriptase in vitro. Both derivatives (9a,b) showed considerable inhibitory effect; ID50 was found to be in the range of 2.8 to 4.5 x 10(-5) M. \ Copyright (C) 1996 Elsevier Science Ltd

  DOI：

  10.1016/s0960-894x(96)00521-5