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4-(环戊烷羰基)苯基硼酸 | 959861-30-4

中文名称
4-(环戊烷羰基)苯基硼酸
中文别名
——
英文名称
4-(Cyclopentanecarbonyl)phenylboronic acid
英文别名
[4-(cyclopentanecarbonyl)phenyl]boronic acid
4-(环戊烷羰基)苯基硼酸化学式
CAS
959861-30-4
化学式
C12H15BO3
mdl
——
分子量
218.06
InChiKey
QUKZBPAMKWYBBY-UHFFFAOYSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    0.74
  • 重原子数:
    16
  • 可旋转键数:
    3
  • 环数:
    2.0
  • sp3杂化的碳原子比例:
    0.42
  • 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-(环戊烷羰基)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-(Cyclopentanecarbonyl)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
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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.
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