(6S,7S)-6-amino-7-hydroxy-4,5,6,7-tetrahydro-imidazo[4,5,1-jk][1]-benzazepin-2[1H]-one | 1044596-71-5

• 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: (6S,7S)-6-amino-7-hydroxy-4,5,6,7-tetrahydro-imidazo[4,5,1-jk][1]-benzazepin-2[1H]-one
• 英文别名: (9S,10S)-10-amino-9-hydroxy-1,3-diazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-2-one
• CAS: 1044596-71-5
• 化学式: C₁₁H₁₃N₃O₂
• 分子量: 219.243
• InChiKey: JJFWDSAUXLLXOO-XVKPBYJWSA-N

物化性质

• 密度：
  1.48±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  -0.8
• 重原子数：
  16
• 可旋转键数：
  0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  78.6
• 氢给体数：
  3
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  4,5-Dihydroimidazo[4,5,1-jk][1]benzazepine-2,6,7(1H)-trione 6-oxime 在 C₃H₇NO*C₄₀H₃₂FeP₂*2Cl^(1-)*Ru⁽²⁺⁾ 氢气 作用下， 以 甲醇 为溶剂， 70.0 ℃ 、5.0 MPa 条件下， 反应 20.0h， 生成 (6R,7R)-6-amino-7-hydroxy-4,5,6,7-tetrahydro-imidazo[4,5,1-jk][1]-benzazepin-2[1H]-one 、 (6S,7S)-6-amino-7-hydroxy-4,5,6,7-tetrahydro-imidazo[4,5,1-jk][1]-benzazepin-2[1H]-one
  参考文献：
  名称：

  WO2008/92924

  摘要：

  公开号：

文献信息

• PROCESS FOR MAKING A CRYSTALLINE ZILPATEROL SALT
  申请人：Krebs Oliver

  公开号：US20120058189A1

  公开（公告）日：2012-03-08

  This invention generally relates to processes for making a crystalline zilpaterol salt, particularly zilpaterol hydrochloride. This invention also relates to methods of treatment using a crystalline zilpaterol salt prepared in accordance with this invention to increase the rate of weight gain, improve feed efficiency, and/or increase carcass leanness in livestock, poultry, and fish.

  本发明通常涉及制备结晶硫扑特罗盐的过程，特别是硫扑特罗盐酸盐。本发明还涉及使用根据本发明制备的结晶硫扑特罗盐的方法，以提高家畜、家禽和鱼类的体重增长速率，改善饲料效率和/或增加胴体瘦肉率。
• [EN] PROCESS FOR MAKING A CRYSTALLINE ZILPATEROL SALT<br/>[FR] PROCÉDÉ POUR LA FABRICATION D'UN SEL DE ZILPATEROL CRISTALLIN
  申请人：INTERVET INT BV

  公开号：WO2010070004A1

  公开（公告）日：2010-06-24

  This invention generally relates to processes for making a crystalline zilpaterol salt, particularly zilpaterol hydrochloride. This invention also relates to methods of treatment using a crystalline zilpaterol salt prepared in accordance with this invention to increase the rate of weight gain, improve feed efficiency, and/or increase carcass leanness in livestock, poultry, and fish.

  这项发明通常涉及制备晶体硫酸盐，特别是晶体盐酸盐。该发明还涉及使用根据本发明制备的晶体硫酸盐进行治疗的方法，以增加家畜、家禽和鱼类的体重增长速度，改善饲料效率，和/或增加胴体瘦肉率。
• Enantioselective synthesis of 6-amino-7-hydroxy-4,5,6,7-tetrahydro-imidazo[4,5,1-JK][1]-benzazepin-2[1H]-one and zilpaterol
  申请人：Almena-Perea Juan Jose

  公开号：US20100173892A1

  公开（公告）日：2010-07-08

  This invention relates to a process for the hydrogenation of a ketooxime to selectively form an aminoalcohol stereoisomer, and, in particular, to a process for the hydrogenation of 4,5-dihydro-imidazo[4,5,1-jk][1]benzazepin-2,6,7[1H]-trione-6-oxime or a salt thereof to selectively form a stereoisomer of 6-amino-7-hydroxy-4,5,6, 7-tetrahydro-imidazo[4,5,1-jk][1]-benzazepin-2[1H]-one or a salt thereof. This invention also relates to the use of the 6-amino-7-hydroxy-4,5,6,7-tetrahydro-imidazo[4,5,1-jk][1]-benzazepin-2[1H]-one hydrogenation product or a salt thereof to selectively make a stereoisomer of zilpaterol or a salt thereof, as well as the use of such a zilpaterol stereoisomer or salt in methods of treatment and medicaments for animals.

  本发明涉及一种氢化酮肟的方法，以选择性地形成氨基醇立体异构体，特别是涉及一种对4,5-二氢咪唑[4,5,1-jk][1]苯并氮杂环-2,6,7[1H]-三酮-6-肟或其盐进行氢化的方法，以选择性地形成6-氨基-7-羟基-4,5,6,7-四氢咪唑[4,5,1-jk][1]-苯并氮杂环-2[1H]-酮或其盐的立体异构体。本发明还涉及使用6-氨基-7-羟基-4,5,6,7-四氢咪唑[4,5,1-jk][1]-苯并氮杂环-2[1H]-酮氢化产物或其盐选择性地制备一种齐帕特罗尔的立体异构体或其盐，以及使用这种齐帕特罗尔立体异构体或其盐在动物治疗和药物中的方法。
• EP1995248A1
  申请人：——

  公开号：EP1995248A1

  公开（公告）日：2008-11-26
• ENANTIOSELECTIVE SYNTHESIS OF 6-AMINO-7-HYDROXY-4, 5, 6, 7-TETRAHYDRO-IMIDAZO [4, 5, 1-JK][1]-BENZAZEPIN-2 [1H]-ONE AND ZILPATEROL
  申请人：Intervet International B.V.

  公开号：EP2109614B1

  公开（公告）日：2014-08-06