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2-[(1E,3E)-4-(6-aminopyridin-3-yl)buta-1,3-dienyl]quinolin-6-ol

中文名称
——
中文别名
——
英文名称
2-[(1E,3E)-4-(6-aminopyridin-3-yl)buta-1,3-dienyl]quinolin-6-ol
英文别名
——
2-[(1E,3E)-4-(6-aminopyridin-3-yl)buta-1,3-dienyl]quinolin-6-ol化学式
CAS
——
化学式
C18H15N3O
mdl
——
分子量
289.3
InChiKey
PRQJDUVRFGYCMD-ZPUQHVIOSA-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):
    3.4
  • 重原子数:
    22
  • 可旋转键数:
    3
  • 环数:
    3.0
  • sp3杂化的碳原子比例:
    0.0
  • 拓扑面积:
    72
  • 氢给体数:
    2
  • 氢受体数:
    4

文献信息

  • Compounds for imaging tau proteins that accumulate in the brain
    申请人:National Institutes for Quantum and Radiological Science and Technology
    公开号:US10604516B2
    公开(公告)日:2020-03-31
    The present invention provides a compound represented by the following formula (I), a pharmaceutically acceptable salt thereof, or a solvate thereof. wherein: R1 and R2 are each separately selected from the group consisting of hydrogen, alkyl, alkenyl, acyl, and hydroxyalkyl; R3 is hydrogen or halogen; ring A is a benzene ring or a pyridine ring; ring B is selected from the group consisting of the following formulas (i), (ii), (iii), and (iv): in the formula (ii), Ra is alkyl; R4 and R5 are each separately selected from the group consisting of hydrogen, hydroxy, alkoxy, haloalkoxy, halohydroxyalkoxy, and aminoalkyl; and   [Formula 3] represents a double bond or a triple bond. The above compound can be used as a molecular probe for imaging tau proteins that accumulate in the brain.
    本发明提供了由下式(I)代表的化合物、其药学上可接受的盐或其溶液。 其中 R1 和 R2 分别选自由氢、烷基、烯基、酰基和羟烷基组成的组; R3 是氢或卤素 环 A 是苯环或吡啶环; 环 B 选自下式 (i)、(ii)、(iii) 和 (iv) 所组成的组: 在式(ii)中,Ra 是烷基; R4 和 R5 分别选自由氢、羟基、烷氧基、卤代烷氧基、卤代羟基烷氧基和基烷基组成的组;以及 [式 3] 代表双键或三键。上述化合物可用作分子探针,对大脑中积累的 tau 蛋白进行成像。
  • NOVEL COMPOUND FOR IMAGING TAU PROTEIN ACCUMULATED IN THE BRAIN
    申请人:National Institutes for Quantum and Radiological Science and Technology
    公开号:EP2767532B1
    公开(公告)日:2016-07-13
  • Novel Compounds for Imaging Tau Proteins That Accumulate in the Brain
    申请人:National Institutes for Quantum and Radiological Science and Technology
    公开号:US20200262829A1
    公开(公告)日:2020-08-20
    The present invention provides a compound represented by the following formula (I), a pharmaceutically acceptable salt thereof, or a solvate thereof. wherein: R 1 and R 2 are each separately selected from the group consisting of hydrogen, alkyl, alkenyl, acyl, and hydroxyalkyl; R 3 is hydrogen or halogen; ring A is a benzene ring or a pyridine ring; ring B is selected from the group consisting of the following formulas (i), (ii), (iii), and (iv): in the formula (ii), R a is alkyl; R 4 and R 5 are each separately selected from the group consisting of hydrogen, hydroxy, alkoxy, haloalkoxy, halohydroxyalkoxy, and aminoalkyl; and [Formula 3] represents a double bond or a triple bond. The above compound can be used as a molecular probe for imaging tau proteins that accumulate in the brain.
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