1-[[4-(Anthracen-9-ylmethoxymethyl)phenyl]methyl]-4-(1-methylpyridin-1-ium-4-yl)pyridin-1-ium | 1020373-52-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 1-[[4-(Anthracen-9-ylmethoxymethyl)phenyl]methyl]-4-(1-methylpyridin-1-ium-4-yl)pyridin-1-ium
• CAS: 1020373-52-7
• 化学式: C₃₄H₃₀N₂O
• 分子量: 482.625
• InChiKey: NEJMVJOFHYVMDW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.9
• 重原子数：
  37
• 可旋转键数：
  7
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  17
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  、 碘甲烷 以 氯仿 、 乙腈 为溶剂， 反应 24.0h， 生成 1-[[4-(Anthracen-9-ylmethoxymethyl)phenyl]methyl]-4-(1-methylpyridin-1-ium-4-yl)pyridin-1-ium
  参考文献：
  名称：

  Bifunctional chemical, preparation and use for detecting nucleic acid

  摘要：

  一种双功能化合物，包括一个分子单元（I），插入在核酸的核碱基（B）之间，一个能够发出可检测信号的活性分子单元（AD），以及可选的间隔单元，其中活性分子单元（AD）被选择自具有与插入分子单元（I）电子相互作用的结构的化学实体中，这样，在氧化反应过程中，由插入分子单元（I）定义的半偶对I+/I的还原-氧化电位（EI+/I）低于由核碱基（B）定义的半偶对B+/B的还原-氧化电位（EB+/B），并且这样，在还原反应过程中，由插入分子单元（I）定义的半偶对I/I−的还原-氧化电位（EI/I−）高于由核碱基（B）定义的半偶对B/B−的还原-氧化电位（EB/B−）。此外，描述了该化合物用于检测核酸、用于其合成的过程以及包含相同的系统。

  公开号：

  US07799912B2

文献信息

• 1-{4-[2-(9-ANTHRYLMETHOXY)ETHYL]BENZYL}-1'-METHYL-4,4'-BIPYRIDINIUM SALTS AND RELATED COMPOUNDS AS BIFUNCTIONAL COMPOUNDS WITH AN INTERCALATING AND A SIGNAL EMITTING UNIT FOR THE DETECTION OF NUCLEIC ACIDS
  申请人：STMicroelectronics Srl

  公开号：EP1914226B1

  公开（公告）日：2010-12-08
• Bifunctional Chemical, Preparation and Use for Detecting Nucleic Acid
  申请人：Conoci Sabrina

  公开号：US20080118405A1

  公开（公告）日：2008-05-22

  A bifunctional compound comprising a molecular unit (I) intercalating between nucleobases (B) of nucleic acids, an active molecular unit (AD) capable of emitting a detectable signal, and optionally a spacer unit, in which the active molecular unit (AD) is selected from amongst chemical entities having a structure such as to interact electronically with the intercalating molecular unit (I) in such a way that, during the reaction of oxidation, the reduction-oxidation potential (EI+/I) of the semicouple I+/I defined by the intercalating molecular unit (I) is lower than the reduction-oxidation potential (EB+/B) of the semicouple B+/B defined by the nucleobases (B), and in such a way that, during the reaction of reduction, the reduction-oxidation potential (EI/I−) of the semicouple I/I− defined by the intercalating molecular unit (I) is higher than the reduction-oxidation potential (EB/B−) of the semicouple B/B− defined by the nucleobases (B). Moreover the use of the compound for detecting nucleic acids, a process for its synthesis, and a system comprising the same are described.
• US7799912B2
  申请人：——

  公开号：US7799912B2

  公开（公告）日：2010-09-21