1-(2-Bromoethoxy)-2-fluoro-4-nitrobenzene | 159471-67-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 1-(2-Bromoethoxy)-2-fluoro-4-nitrobenzene
• CAS: 159471-67-7
• 化学式: C₈H₇BrFNO₃
• 分子量: 264.051
• InChiKey: VKSUYJNTQLJACH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.6
• 重原子数：
  14
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  55
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  1-(2-Bromoethoxy)-2-fluoro-4-nitrobenzene 在 palladium on activated charcoal 吡啶 、 氢气 作用下， 以 甲醇 、 乙醇 、 乙腈 为溶剂， 生成 N-[4-[2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]ethoxy]-3-fluorophenyl]methanesulfonamide
  参考文献：
  名称：

  Synthesis and biological activity of KCB-328 and its analogues: Novel class III antiarrhythmic agents with little reverse frequency dependence

  摘要：

  A series of 3,4-dimethoxyphenethylamine derivatives was prepared, and their prolongation effects on effective refractory period of contractile response (ERPc) and action potential duration (APD) in isolated guinea-pig papillary muscles at 1 Hz and 3 Hz were examined. SAR studies led to the identification of KCB-328 (51) which is a novel class III antiarrhythmic agent with little reverse frequency dependence. (C) 1998 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(98)00689-1
• 作为产物：
  描述：

  2-氟-4-硝基苯酚 、 1,2-二溴乙烷 在 potassium carbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 生成 1-(2-Bromoethoxy)-2-fluoro-4-nitrobenzene
  参考文献：
  名称：

  Synthesis and biological activity of KCB-328 and its analogues: Novel class III antiarrhythmic agents with little reverse frequency dependence

  摘要：

  A series of 3,4-dimethoxyphenethylamine derivatives was prepared, and their prolongation effects on effective refractory period of contractile response (ERPc) and action potential duration (APD) in isolated guinea-pig papillary muscles at 1 Hz and 3 Hz were examined. SAR studies led to the identification of KCB-328 (51) which is a novel class III antiarrhythmic agent with little reverse frequency dependence. (C) 1998 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(98)00689-1

文献信息

• Synthesis and biological activity of KCB-328 and its analogues: Novel class III antiarrhythmic agents with little reverse frequency dependence
  作者：Dong-Ick Kim、Hak-Yeop Kim、Lae-Sung Kwon、Sung-Dae Park、Gee-Ho Jeon、Kyung-Yun Jung、Jae-Ki Min、Woong-Hyun Nam、Kiho Lee、You-Sup Chung、Shigeru Tanabe、Toshiro Kozono

  DOI：10.1016/s0960-894x(98)00689-1

  日期：1999.1

  A series of 3,4-dimethoxyphenethylamine derivatives was prepared, and their prolongation effects on effective refractory period of contractile response (ERPc) and action potential duration (APD) in isolated guinea-pig papillary muscles at 1 Hz and 3 Hz were examined. SAR studies led to the identification of KCB-328 (51) which is a novel class III antiarrhythmic agent with little reverse frequency dependence. (C) 1998 Elsevier Science Ltd. All rights reserved.