4-[(1R,9aR)-1-(octahydro-quinolizin-1-yl)methoxy]-phenylamine | 947234-79-9

• 分子结构分类: 有机化合物 - 生物碱及其衍生物 - 羽扇豆生物碱
• 英文名称: 4-[(1R,9aR)-1-(octahydro-quinolizin-1-yl)methoxy]-phenylamine
• 英文别名: 4-[(1R,9aR)-1-(octahydroquinolizin-1-yl)methoxy]phenylamine；4-[[(1R,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methoxy]aniline
• CAS: 947234-79-9
• 化学式: C₁₆H₂₄N₂O
• 分子量: 260.379
• InChiKey: TZQRDGBYUMWAIM-XJKSGUPXSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  19
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.62
• 拓扑面积：
  38.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  4-[(1R,9aR)-1-(octahydro-quinolizin-1-yl)methoxy]-phenylamine 、 4-丁氧基苯甲酸 在 O-[(ethoxycarbonyl)cyanomethyleneamino]-N,N,N',N'-tetramethyluronium tetrafluoroborate 、 N,N-二异丙基乙胺 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 3.0h， 生成 4-butoxy-N-{4-[(1R,9aR)-1-(octahydro-quinolizin-1-yl)methoxy]-phenyl}-benzamide
  参考文献：
  名称：

  [DE] ARYLSUBSTITUIERTE POLYCYCLISCHE AMINE, VERFAHREN ZU IHRER HERSTELLUNG UND IHRE VERWENDUNG ALS ARZNEIMITTEL
  [EN] ARYL-SUBSTITUTED POLYCYCLIC AMINES, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF AS A MEDICAMENT
  [FR] AMINES POLYCYCLIQUES SUBSTITUES PAR ARYLE, PROCEDE DE PRODUCTION ASSOCIE ET LEUR UTILISATION EN TANT QUE MEDICAMENTS

  摘要：

  公开号：

  WO2006018279A3
• 作为产物：
  描述：

  (1R,9aR)-1-(4-Nitrophenoxymethyl)octahydroquinolizine 在 palladium(II) hydroxide/carbon 氢气 作用下， 以 乙醇 为溶剂， 反应 3.0h， 生成 4-[(1R,9aR)-1-(octahydro-quinolizin-1-yl)methoxy]-phenylamine
  参考文献：
  名称：

  [DE] ARYLSUBSTITUIERTE POLYCYCLISCHE AMINE, VERFAHREN ZU IHRER HERSTELLUNG UND IHRE VERWENDUNG ALS ARZNEIMITTEL
  [EN] ARYL-SUBSTITUTED POLYCYCLIC AMINES, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF AS A MEDICAMENT
  [FR] AMINES POLYCYCLIQUES SUBSTITUES PAR ARYLE, PROCEDE DE PRODUCTION ASSOCIE ET LEUR UTILISATION EN TANT QUE MEDICAMENTS

  摘要：

  公开号：

  WO2006018279A3

文献信息

• ARYL-SUBSTITUTED POLYCYCLIC AMINES, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF AS A MEDICAMENT
  申请人：SCHWINK Lothar

  公开号：US20070197584A1

  公开（公告）日：2007-08-23

  The invention relates to aryl-substituted polycyclic amines of the formula I, especially bicyclic amines, and to the physiologically tolerated salts and physiologically functional derivatives thereof; where the symbols and radicals are explained in the description as well as to pharmaceutical compositions and medical treatments employing these compounds.

  该发明涉及公式I的芳基取代的多环胺，特别是双环胺，以及其生理耐受的盐和生理功能衍生物；其中符号和基团在描述中有解释，还涉及使用这些化合物的药物组合物和医疗治疗。
• USE OF ARYL-SUBSTITUTED POLYCYCLIC AMINES AS MEDICAMENTS
  申请人：SCHWINK Lothar

  公开号：US20090258872A1

  公开（公告）日：2009-10-15

  The invention relates to therapeutic use of aryl-substituted polycyclic amines of the formula I, especially bicyclic amines, and to the physiologically tolerated salts and physiologically functional derivatives thereof; where the symbols and radicals are explained in the description.

  本发明涉及公式I的芳基取代多环胺的治疗用途，特别是双环胺，以及其生理上耐受的盐和生理上功能性衍生物；其中符号和基团在说明中解释。
• NOVEL AMINOALCOHOL-SUBSTITUTED ARYLDIHYDROISOQUINOLINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS
  申请人：SCHWINK Lothar

  公开号：US20090082391A1

  公开（公告）日：2009-03-26

  The invention relates to aminoalcohol-substituted aryldihydroisoquinolinones and their derivatives, and their physiologically tolerated salts and physiologically functional derivatives, their preparation, medicaments comprising at least one aminoalcohol-substituted aryldihydroisoquinolinone of the invention or its derivative, and the use of the aminoalcohol-substituted aryldihydroisoquinolinones of the invention and their derivatives as MCH antagonists.

  本发明涉及氨基醇取代的芳基二氢异喹啉酮及其衍生物，以及其生理耐受盐和生理功能衍生物、其制备方法、至少包含本发明中的一种氨基醇取代的芳基二氢异喹啉酮或其衍生物的药物，以及将本发明中的氨基醇取代的芳基二氢异喹啉酮及其衍生物用作MCH拮抗剂的用途。
• NOVEL AMINO ALCOHOL-SUBSTITUTED ARYLTHIENOPYRIMIDINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS
  申请人：SCHWINK Lothar

  公开号：US20090076002A1

  公开（公告）日：2009-03-19

  The invention relates to amino alcohol-substituted arylthienopyrimidinones and their derivatives, and their physiologically tolerated salts and physiologically functional derivatives, their preparation, medicaments comprising at least one amino alcohol-substituted arylthienopyrimidinone of the invention or its derivative, and the use of the amino alcohol-substituted arylthienopyrimidinones of the invention and their derivatives as MCH antagonists.

  本发明涉及氨基醇取代的芳基噻唑嘧啶酮及其衍生物、其生理上可耐受的盐和生理功能衍生物、其制备方法、包含本发明中至少一种氨基醇取代的芳基噻唑嘧啶酮或其衍生物的药物以及将本发明中的氨基醇取代的芳基噻唑嘧啶酮及其衍生物用作MCH拮抗剂的用途。
• Use of aryl-substituted polycyclic amines as medicaments
  申请人：Sanofi-Aventis Deutschland GmbH

  公开号：US08163741B2

  公开（公告）日：2012-04-24

  The invention relates to therapeutic use of aryl-substituted polycyclic amines of the formula I, especially bicyclic amines, and to the physiologically tolerated salts and physiologically functional derivatives thereof; where the symbols and radicals are explained in the description.

  该发明涉及公式I中芳基取代的多环胺的治疗用途，特别是双环胺，以及其生理耐受的盐和生理功能衍生物的使用；其中符号和基团在说明中解释。