6,8-difluoro-7-(4-hydroxyphenyl)-1-cyclopropyl-4-quinoline-3-carboxylic acid | 136440-70-5

• 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: 6,8-difluoro-7-(4-hydroxyphenyl)-1-cyclopropyl-4-quinoline-3-carboxylic acid
• 英文别名: 1-cyclopropyl-6,8-difluoro-7-(4-hydroxyphenyl)-4-quinolone-3-carboxylic acid；CP-115.953；1-Cyclopropyl-6,8-difluoro-1,4-dihydro-7-(4-hydroxyphenyl)-4-oxo-3-quinolinecarboxylic acid；1-cyclopropyl-6,8-difluoro-7-(4-hydroxyphenyl)-4-oxoquinoline-3-carboxylic acid
• CAS: 136440-70-5
• 化学式: C₁₉H₁₃F₂NO₄
• 分子量: 357.313
• InChiKey: ISQTYKAFNUVODK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4
• 重原子数：
  26
• 可旋转键数：
  3
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.16
• 拓扑面积：
  77.8
• 氢给体数：
  2
• 氢受体数：
  7

反应信息

• 作为产物：
  描述：

  ethyl 1-cyclopropyl-6,8-difluoro-7-(4-hydroxyphenyl)-4-oxo-1,4-dihydroquinoline-3-carboxylate 在 盐酸 、 水 作用下， 以 四氢呋喃 为溶剂， 反应 1.0h， 以89%的产率得到6,8-difluoro-7-(4-hydroxyphenyl)-1-cyclopropyl-4-quinoline-3-carboxylic acid
  参考文献：
  名称：

  通往关键中间体的简洁途径，可多样化合成C7取代的氟喹诺酮衍生物

  摘要：

  已经开发出一种简明的路线来制备7-溴-1-环丙基-6,8-二氟-4-喹诺酮-3-羧酸乙酯。该化合物是多种C7取代的氟喹诺酮类药物（多种有前景的临床应用的有效拓扑异构酶II抑制剂）的多样化合成的关键中间体。

  DOI：

  10.1016/j.tetlet.2009.11.077

文献信息

• Compounds and Methods for modulating the Silencing of a Polynucleotide of Interest
  申请人：Peng Jin

  公开号：US20090306035A1

  公开（公告）日：2009-12-10

  Methods and compositions comprising chemical compounds that modulate the silencing of a polynucleotide of interest in a cell are provided. Such chemical compounds when used in combination with an appropriate silencing element can be used to modulate (increase or decrease) the level of the polynucleotide targeted by the silencing element. Methods of using such compositions both in therapies involving RNAi-mediated suppression of gene expression, as well as, in vitro methods that allow for the targeted modulation of expression of a polynucleotide of interest are provided. Pharmaceutical or cosmetic formulations comprising such compounds and silencing elements also are disclosed. Methods for screening a compound of interest for the ability to modulate the activity of a heterologous silencing element also are provided.
• Concise route to the key intermediate for divergent synthesis of C7-substituted fluoroquinolone derivatives
  作者：Xin Zhang、Feng Mu、Bobby Robinson、Pengfei Wang

  DOI：10.1016/j.tetlet.2009.11.077

  日期：2010.1

  A concise route to ethyl 7-bromo-1-cyclopropyl-6,8-difluoro-4-quinolone-3-carboxylate has been developed. This compound is a key intermediate for divergent synthesis of various C7-substituted fluoroquinolones, a group of potent topoisomerase II inhibitors with promising clinical applications.

  已经开发出一种简明的路线来制备7-溴-1-环丙基-6,8-二氟-4-喹诺酮-3-羧酸乙酯。该化合物是多种C7取代的氟喹诺酮类药物（多种有前景的临床应用的有效拓扑异构酶II抑制剂）的多样化合成的关键中间体。