N-phenyl-3-methoxyindole-2-carboxylic acid methyl ester | 85793-70-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吲哚及其衍生物
• 英文名称: N-phenyl-3-methoxyindole-2-carboxylic acid methyl ester
• 英文别名: N-phenyl-3-methoxyindole-2-carboxylic acid methylester；Methyl 3-methoxy-1-phenyl-1H-indole-2-carboxylate；methyl 3-methoxy-1-phenylindole-2-carboxylate
• CAS: 85793-70-0
• 化学式: C₁₇H₁₅NO₃
• 分子量: 281.311
• InChiKey: QUNONUINNDDPOX-UHFFFAOYSA-N

物化性质

• 沸点：
  373.4±35.0 °C(Predicted)
• 密度：
  1.17±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  21
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  40.5
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  N-phenyl-3-methoxyindole-2-carboxylic acid methyl ester 生成 3-Methoxy-1-phenyl-1H-indole-2-carboxylic acid
  参考文献：
  名称：

  OHLENDORF, H. -W.;KAUPMANN, W.;KUEHL, U.;BUSCHMANN, G.;MAGDA, S. J.

  摘要：

  DOI：
• 作为产物：
  描述：

  methyl 3-oxo-1-phenylindoline-2-carboxylate 、 硫酸二甲酯 生成 N-phenyl-3-methoxyindole-2-carboxylic acid methyl ester
  参考文献：
  名称：

  OHLENDORF, H. -W.;KAUPMANN, W.;KUEHL, U.;BUSCHMANN, G.;MAGDA, S. J.

  摘要：

  DOI：

文献信息

• 1-Phenyl-2-aminocarbonylindole compounds, preparation thereof and
  申请人：Kali-Chemie Pharma GmbH

  公开号：US04803198A1

  公开（公告）日：1989-02-07

  New 1-phenyl-2-aminocarbonylindole compounds are described which have the general formula I ##STR1## where R.sub.1 is a hydrogen atom, or a lower alkyl, alkenyl, cycloalkylalkyl radical, R.sub.2 is a hydrogen atom or a lower alkyl radical, R.sub.3 is a hydrogen or halogen atom, or a lower alkyl, hydroxyl or lower alkoxy radical, R.sub.4 is a hydrogen or halogen atom, or a lower alkyl, hydroxyl or lower alkoxy radical, or, if R.sub.3 is a hydrogen atom, R.sub.4 may be a nitro or trifluoromethyl radical, or R.sub.3 and R.sub.4 together denote a methylenedioxy or ethylenedioxy radical, R.sub.5 has the meanings given for R.sub.3, R.sub.6 has the meanings given for R.sub.4, R.sub.7 is a hydrogen atom or, if R.sub.5 and R.sub.6 are lower alkoxy radicals, R.sub.7 may also be a lower alkoxy radical, R.sub.8 and R.sub.9 are each a hydrogen atom or a lower alkyl radical or, together with the nitrogen atom, form a heterocyclic group, and Z is an alkylene chain which is optionally substituted by hydroxyl. The compounds have pharmaceutical properties, in particular antiarrhythmic properties. The compounds may be in the form of the free bases or acid addition salts. Pharmaceutical compositions containing these compounds are described as is a method of preparing them. Valuable intermediates for the production of these compounds and methods of preparing the intermediates are also described.

  描述了具有通式I的新1-苯基-2-氨基甲酰吲哚化合物，其中R.sub.1是氢原子，或者是较低的烷基、烯基、环烷基烷基基团，R.sub.2是氢原子或较低的烷基基团，R.sub.3是氢原子或卤素原子，或者是较低的烷基、羟基或较低的烷氧基团，R.sub.4是氢原子或卤素原子，或者是较低的烷基、羟基或较低的烷氧基团，或者，如果R.sub.3是氢原子，R.sub.4可以是硝基或三氟甲基基团，或者R.sub.3和R.sub.4一起表示亚甲二氧基或乙二氧基基团，R.sub.5具有R.sub.3给出的含义，R.sub.6具有R.sub.4给出的含义，R.sub.7是氢原子或者，如果R.sub.5和R.sub.6是较低的烷氧基基团，R.sub.7也可以是较低的烷氧基基团，R.sub.8和R.sub.9分别是氢原子或较低的烷基基团，或者与氮原子一起形成杂环基团，Z是一条可以由羟基取代的烷基链。这些化合物具有药理学性质，特别是抗心律失常性质。这些化合物可以是自由碱或酸盐的形式。描述了含有这些化合物的药物组合物，以及其制备方法。还描述了用于生产这些化合物的有价值的中间体以及制备这些中间体的方法。
• Acidic tetrazolyl substituted indole compounds and their use as
  申请人：Warner-Lambert Company

  公开号：US04675332A1

  公开（公告）日：1987-06-23

  Novel acidic indole compounds having use as antiallergic agents, methods of synthesis, compositions, and uses are claimed.

  声称拥有作为抗过敏剂使用的新型酸性吲哚化合物，合成方法，组成物和用途。
• Acidic indole compounds and their use as antiallergy agents
  申请人：WARNER-LAMBERT COMPANY

  公开号：EP0186367A2

  公开（公告）日：1986-07-02

  There are disclosed compounds having the following general formula (I): and pharmaceutically acceptable salts thereof, wherein: R' and Q are each, independently, H, an alkyl having from one to twelve carbon atoms, an alkoxy having from one to twelve carbon atoms, mercapto. an alkylthio having from one to four carbon atoms, an alkylsulphinyl having from one to four carbon atoms, an alkylsulphonyl having from one to four carbon atoms, a hydroxy group, a nitro group, an amino group, substituted amino group or a halogen, R' being further chosen from a methylenedioxy radical attached to adjacent carbon atoms of the benzene ring; R2 is H, an alkyl having from one to twelve carbon atoms, a phenyl radical, a substituted phenyl radical or a benzyl radical; R3 is H, an alkyl having from one to twelve carbon atoms, an alkoxy having from one to twelve carbon atoms, mercapto, an alkylthio having from one to four carbon atoms, a phenylthio radical, a substituted phenylthio radical, an alkylsulphinyl having from one to four carbon atoms, a phenylsulphinyl radical, a substituted phenylsulphinyl radical, an alkylsulphonyl hving from one to four carbon atoms, a phenylsolphonyl radical, a substituted phenylsolphonyl radical an amino group, or a substitued amino group; and R4 is Methods of preparing the compounds, compositions comprising the compounds and the pharmaceutical use of the compounds are also disclosed.

  公开了具有以下通式(I)的化合物： 及其药学上可接受的盐类，其中 R'和 Q 各自独立地为 H、1-12 个碳原子的烷基、1-12 个碳原子的烷氧基、1-4 个碳原子的巯基、1-4 个碳原子的烷硫基、1-4 个碳原子的烷基亚磺酰基、1-4 个碳原子的烷基磺酰基、羟基、硝基、氨基、取代氨基或卤素，R'可进一步选自连接到苯环相邻碳原子上的亚甲二氧基； R2 是 H、具有 1 至 12 个碳原子的烷基、苯基、取代苯基或苄基； R3 是 H、具有一至十二个碳原子的烷基、具有一至十二个碳原子的烷氧基、巯基、具有一至四个碳原子的烷硫基、苯硫基、取代的苯硫基、具有一至四个碳原子的烷基亚磺酰基、一个氨基或一个取代氨基；和 R4 是 还公开了制备这些化合物的方法、包含这些化合物的组合物以及这些化合物的药物用途。
• OHLENDORF, H. -W.;KAUPMANN, W.;KUEHL, U.;BUSCHMANN, G.;MAGDA, S. J.
  作者：OHLENDORF, H. -W.、KAUPMANN, W.、KUEHL, U.、BUSCHMANN, G.、MAGDA, S. J.

  DOI：——

  日期：——
• US4675332A
  申请人：——

  公开号：US4675332A

  公开（公告）日：1987-06-23