4-(环丙基羰基)苯基硼酸 | 959861-28-0

• 分子结构分类: 有机化合物 - 有机氧化合物
• 中文名称: 4-(环丙基羰基)苯基硼酸
• 中文别名: 4-(环丙基羰基)苯硼酸
• 英文名称: (4-(Cyclopropanecarbonyl)phenyl)boronic acid
• 英文别名: [4-(cyclopropanecarbonyl)phenyl]boronic acid
• CAS: 959861-28-0
• 化学式: C₁₀H₁₁BO₃
• mdl: MFCD06801673
• 分子量: 190.007
• InChiKey: WIROHRLGTDEXLM-UHFFFAOYSA-N

物化性质

• 沸点：
  396.4±44.0 °C(Predicted)
• 密度：
  1.25±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.63
• 重原子数：
  14
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  57.5
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  、 4-(环丙基羰基)苯基硼酸 在 bis-triphenylphosphine-palladium(II) chloride potassium carbonate 作用下， 以 乙醇 、 甲苯 为溶剂， 生成 7-(4-(Cyclopropanecarbonyl)phenyl)-4-(phenylamino)quinoline-3-carboxamide
  参考文献：
  名称：

  Synthesis of novel anilinoquinolines as c-fms inhibitors

  摘要：

  A novel series of potent substituted anilinoquinolines were discovered as c-fms inhibitors. The potency could be manipulated upon modification of the C4 aniline and C7 aryl functionality. Pharmacokinetic analysis identified a metabolically stable analog suitable for further investigative work. (C) 2007 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2007.09.009

文献信息

• Synthesis of novel anilinoquinolines as c-fms inhibitors
  作者：Terrence L. Smalley、Stanley D. Chamberlain、Wendy Y. Mills、David L. Musso、Sab A. Randhawa、John A. Ray、Vicente Samano、Lloyd Frick

  DOI：10.1016/j.bmcl.2007.09.009

  日期：2007.11

  A novel series of potent substituted anilinoquinolines were discovered as c-fms inhibitors. The potency could be manipulated upon modification of the C4 aniline and C7 aryl functionality. Pharmacokinetic analysis identified a metabolically stable analog suitable for further investigative work. (C) 2007 Elsevier Ltd. All rights reserved.