3-[1-((1R,2R)-4,6-difluoro-2-hydroxy-indan-1-yl)-5-(3,3,3-trifluoro-propyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl]-benzonitrile | 1427414-73-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 3-[1-((1R,2R)-4,6-difluoro-2-hydroxy-indan-1-yl)-5-(3,3,3-trifluoro-propyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl]-benzonitrile
• 英文别名: 3-(1-((1R,2R)-4,6-difluoro-2-hydroxy-indan-1-yl)-5-(3,3,3-trifluoropropyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)benzonitrile；3-[1-((1R,2R)-4,6-difluoro-2-hydroxyindan-1-yl)-5-(3,3,3-trifluoropropyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl]benzonitrile；3-[1-[(1R,2R)-4,6-difluoro-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-5-(3,3,3-trifluoropropyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]benzonitrile
• CAS: 1427414-73-0
• 化学式: C₂₅H₂₁F₅N₄O
• 分子量: 488.46
• InChiKey: HFFVGXLPMXNQIB-ISKFKSNPSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.2
• 重原子数：
  35
• 可旋转键数：
  4
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  65.1
• 氢给体数：
  1
• 氢受体数：
  9

反应信息

• 作为产物：
  描述：

  1-碘-3,3,3-三氟丙烷 、 3-[1-((1R,2R)-4,6-difluoro-2-hydroxy-indan-1-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl]-benzonitrile 在 三乙胺 、 三氟乙酸 作用下， 以 乙腈 、 水 为溶剂， 反应 18.0h， 生成 3-[1-((1R,2R)-4,6-difluoro-2-hydroxy-indan-1-yl)-5-(3,3,3-trifluoro-propyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl]-benzonitrile 、 3-[1-((1R,2R)-4,6-difluoro-2-hydroxyindan-1-yl)-5-(3,3,3-trifluoropropyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl]benzamide trifluoroacetic acid
  参考文献：
  名称：

  Indanyl-Substituted 4,5,6,7-Tetrahydro-1H-Pyrazolo[4,3-C]Pyridines, Their Use as Medicament, and Pharmaceutical Preparations Comprising Them

  摘要：

  这项发明涉及公式(I)的取代4,5,6,7-四氢-1H-吡唑并[4,3-c]吡啶，它们作为药物的用途，以及包含它们的药物制剂。公式(I)的化合物对TASK-1钾通道起作用。这些化合物特别适用于治疗或预防心房心律失常，例如心房颤动（AF）或心房扑动。

  公开号：

  US20140378686A1

文献信息

• [EN] INDANYL-SUBSTITUTED 4,5,6,7-TETRAHYDRO-1H-PYRAZOLO[4,3-C]PYRIDINES, THEIR USE AS MEDICAMENT, AND PHARMACEUTICAL PREPARATIONS COMPRISING THEM<br/>[FR] 4,5,6,7-TÉTRAHYDRO-1H-PYRAZOLO[4,3-C]PYRIDINES SUBSTITUÉES AVEC UN INDANYLE, LEUR UTILISATION COMME MÉDICAMENT, ET PRÉPARATIONS PHARMACEUTIQUES LES CONTENANT
  申请人：SANOFI SA

  公开号：WO2013037736A1

  公开（公告）日：2013-03-21

  The invention relates to substituted 4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridines of formula (I), their use as medicament, and pharmaceutical preparations comprising them. The compounds of formula I act on the TASK-1 potassium channel. The compounds are suitable for the treatment or prevention of atrial arrhythmias, for example atrial fibrillation (AF) or atrial flutter.

  该发明涉及公式（I）的取代4,5,6,7-四氢-1H-吡唑并[4,3-c]吡啶，其用作药物，以及包含它们的药物制剂。公式I的化合物对TASK-1钾通道起作用。这些化合物适用于治疗或预防心房心律失常，例如心房颤动（AF）或心房扑动。
• [EN] INDANYL-SUBSTITUTED 4,5,6,7-TETRAHYDRO-1H-PYRAZOLO[4,3-C]PYRIDINES, THEIR USE AS MEDICAMENT, AND PHARMACEUTICAL PREPARATIONS COMPRISING THEM<br/>[FR] 4,5,6,7-TÉTRAHYDRO-1H-PYRAZOLO[4,3-C]PYRIDINES À SUBSTITUTION INDANYLE, LEUR UTILISATION EN TANT QUE MÉDICAMENT ET PRÉPARATIONS PHARMACEUTIQUES LES COMPRENANT
  申请人：SANOFI SA

  公开号：WO2013037389A1

  公开（公告）日：2013-03-21

  The invention relates to substituted 4,5,6,7-tetrahydro-1 H-pyrazolo[4,3-c]pyridines of formula (I), their use as medicament, and pharmaceutical preparations comprising them. The compounds of formula (I) act on the TASK-1 potassium channel. The compounds are particularly suitable for the treatment or prevention of atrial arrhythmias, for example atrial fibrillation (AF) or atrial flutter.

  该发明涉及式(I)的取代4,5,6,7-四氢-1H-吡唑并[4,3-c]吡啶，其用作药物，以及含有它们的药物制剂。式(I)的化合物对TASK-1钾通道起作用。这些化合物特别适用于治疗或预防心房心律失常，例如心房颤动（AF）或心房扑动。
• INDANYL-SUBSTITUTED 4,5,6,7-TETRAHYDRO-1H-PYRAZOLO[4,3-C]PYRIDINES, THEIR USE AS MEDICAMENT, AND PHARMACEUTICAL PREPARATIONS COMPRISING THEM
  申请人：SANOFI

  公开号：EP2755972B1

  公开（公告）日：2015-10-28
• US9034897B2
  申请人：——

  公开号：US9034897B2

  公开（公告）日：2015-05-19
• Indanyl-Substituted 4,5,6,7-Tetrahydro-1H-Pyrazolo[4,3-C]Pyridines, Their Use as Medicament, and Pharmaceutical Preparations Comprising Them
  申请人：Bialy Laurent

  公开号：US20140378686A1

  公开（公告）日：2014-12-25

  The invention relates to substituted 4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridines of formula (I), their use as medicament, and pharmaceutical preparations comprising them. The compounds of formula (I) act on the TASK-1 potassium channel. The compounds are particularly suitable for the treatment or prevention of atrial arrhythmias, for example atrial fibrillation (AF) or atrial flutter.

  这项发明涉及公式(I)的取代4,5,6,7-四氢-1H-吡唑并[4,3-c]吡啶，它们作为药物的用途，以及包含它们的药物制剂。公式(I)的化合物对TASK-1钾通道起作用。这些化合物特别适用于治疗或预防心房心律失常，例如心房颤动（AF）或心房扑动。