10,11-Dihydro-5H-3,11-diaza-dibenzo[a,d]cycloheptene | 516514-30-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯氮卓类
• 英文名称: 10,11-Dihydro-5H-3,11-diaza-dibenzo[a,d]cycloheptene
• 英文别名: 6,11-dihydro-5H-pyrido[4,3-c][2]benzazepine
• CAS: 516514-30-0
• 化学式: C₁₃H₁₂N₂
• 分子量: 196.252
• InChiKey: OKYRWRWWPCASON-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  15
• 可旋转键数：
  0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.15
• 拓扑面积：
  24.9
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  10,11-Dihydro-5H-3,11-diaza-dibenzo[a,d]cycloheptene 在 2-(Phenylsulfonyl)-3-phenyloxaziridin 作用下， 以 二氯甲烷 为溶剂， 生成 10,11-Dihydro-5H-3,11-diaza-dibenzo[a,d]cycloheptene 3-oxide
  参考文献：
  名称：

  2-(Dimethylaminomethyl)-tetrahydroisoxazolopyridobenzazepine derivatives. Synthesis of a new 5-HT2C antagonist with potential anxiolytic properties

  摘要：

  Following the program started at Johnson & Johnson Pharmaceutical Research & Development searching for 5-HT2A/2C antagonists, we now report on the synthesis of 2-(dimethylaminomethyl)-2,3,3a,8-tetrahydroisoxazolo[3,2-a]pyrido[3,4-c]-[2]benzazepine and 2-(dimethylaminomethyl)-2,3,3a,8-tetrahydroisoxazolo[3,2-a]pyrido[3,2-c]-[2]benzazepine. A new method for the synthesis of pyridobenzazepines is described as well. The affinities for several receptors as well as the mCPP antagonistic activity of the compounds synthesised are described. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(02)00796-5
• 作为产物：
  描述：

  4-amino-3-benzoylpyridine 在 氢氧化钾 、 一水合肼 、 三氟乙酸 作用下， 以 乙二醇 为溶剂， 反应 5.0h， 生成 10,11-Dihydro-5H-3,11-diaza-dibenzo[a,d]cycloheptene
  参考文献：
  名称：

  2-(Dimethylaminomethyl)-tetrahydroisoxazolopyridobenzazepine derivatives. Synthesis of a new 5-HT2C antagonist with potential anxiolytic properties

  摘要：

  Following the program started at Johnson & Johnson Pharmaceutical Research & Development searching for 5-HT2A/2C antagonists, we now report on the synthesis of 2-(dimethylaminomethyl)-2,3,3a,8-tetrahydroisoxazolo[3,2-a]pyrido[3,4-c]-[2]benzazepine and 2-(dimethylaminomethyl)-2,3,3a,8-tetrahydroisoxazolo[3,2-a]pyrido[3,2-c]-[2]benzazepine. A new method for the synthesis of pyridobenzazepines is described as well. The affinities for several receptors as well as the mCPP antagonistic activity of the compounds synthesised are described. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(02)00796-5

文献信息

• Pyridine derivatives and intermediates thereof
  申请人：KYOWA HAKKO KOGYO CO., LTD.

  公开号：EP0347831A2

  公开（公告）日：1989-12-27

  A pyridine derivative of formula wherein X¹-X² represents wherein wherein R⁴ represents hydrogen alkyl or a substituted or unsubstituted aralkyl; R⁵ reoresents a hydrogen, alkoxy or alkylthio and R⁶ and R⁸, which may be the same or different, each represent hydrogen, alkyl or alkenyl, R⁷ represents hydrogen or R⁶ and R⁷ are taken together to form wherein R⁹ represents alkyl; and m represents an integer of from 1 to 3; and any one of a, b, and c represents a nitrogen or an N-oxide (N→O), with the other two representing a carbon atom, which exhibits selective, potential, and long-lasting inhibitory activity on biosynthesis of thromboxane A₂ and is useful in the treatment and prevention of a broad range of diseases.

  式中的吡啶衍生物 其中 X¹-X² 代表 其中 其中 R⁴ 代表氢烷基或取代或未取代的芳烷基；R⁵ 代表氢、烷氧基或硫代烷基，R⁶ 和 R⁸ 可以相同或不同，各自代表氢、烷基或烯基，R⁷ 代表氢或 R⁶ 和 R⁷ 结合在一起构成 其中 R𠞙 代表烷基；m 代表 1 至 3 的整数；a、b 和 c 中的任何一个代表氮或 N-氧化物（N→O），另外两个代表碳原子，对血栓素 A₂ 的生物合成具有选择性、潜在和持久的抑制活性，可用于治疗和预防多种疾病。
• 2-(Dimethylaminomethyl)-tetrahydroisoxazolopyridobenzazepine derivatives. Synthesis of a new 5-HT2C antagonist with potential anxiolytic properties
  作者：J.Ignacio Andrés、José M. Alonso、Javier Fernández、Laura Iturrino、Pedro Martı́nez、Theo F. Meert、Victor K. Sipido

  DOI：10.1016/s0960-894x(02)00796-5

  日期：2002.12

  Following the program started at Johnson & Johnson Pharmaceutical Research & Development searching for 5-HT2A/2C antagonists, we now report on the synthesis of 2-(dimethylaminomethyl)-2,3,3a,8-tetrahydroisoxazolo[3,2-a]pyrido[3,4-c]-[2]benzazepine and 2-(dimethylaminomethyl)-2,3,3a,8-tetrahydroisoxazolo[3,2-a]pyrido[3,2-c]-[2]benzazepine. A new method for the synthesis of pyridobenzazepines is described as well. The affinities for several receptors as well as the mCPP antagonistic activity of the compounds synthesised are described. (C) 2002 Elsevier Science Ltd. All rights reserved.