3-(3,5-dichloro-4-hydroxyphenyl)-N-(4-(4-fluoro-3-(trifluoromethyl)phenoxy)benzyl)-1,2,4-oxadiazole-5-carboxamide | 1191253-90-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 3-(3,5-dichloro-4-hydroxyphenyl)-N-(4-(4-fluoro-3-(trifluoromethyl)phenoxy)benzyl)-1,2,4-oxadiazole-5-carboxamide
• 英文别名: 3-(3,5-dichloro-4-hydroxyphenyl)-N-[[4-[4-fluoro-3-(trifluoromethyl)phenoxy]phenyl]methyl]-1,2,4-oxadiazole-5-carboxamide
• CAS: 1191253-90-3
• 化学式: C₂₃H₁₃Cl₂F₄N₃O₄
• 分子量: 542.274
• InChiKey: RDUDACWWACPOJK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.3
• 重原子数：
  36
• 可旋转键数：
  6
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.09
• 拓扑面积：
  97.5
• 氢给体数：
  2
• 氢受体数：
  10

反应信息

• 作为产物：
  描述：

  3-(3,5-dichloro-4-(4-methoxybenzyloxy)phenyl)-N-(4-hydroxybenzyl)-1,2,4-oxadiazole-5-carboxamide 、 4-氟-3-三氟甲基苯基硼酸 在 copper diacetate 吡啶 、 三氟乙酸 作用下， 以 二氯甲烷 为溶剂， 反应 29.0h， 以71%的产率得到3-(3,5-dichloro-4-hydroxyphenyl)-N-(4-(4-fluoro-3-(trifluoromethyl)phenoxy)benzyl)-1,2,4-oxadiazole-5-carboxamide
  参考文献：
  名称：

  Compounds, Compositions and Methods Comprising Oxadiazole Derivatives

  摘要：

  本发明涉及用于治疗动物患病的组合物和方法，该疾病对通过向需要的哺乳动物施用本文所定义的化合物的有效量（包括表1-2中列出的化合物或被公式I-IV包含的化合物）或其组合物以抑制功能性囊性纤维化跨膜传导调节蛋白（CFTR）多肽作出反应，从而治疗该疾病。本发明特别涉及一种治疗腹泻和多囊肾病的方法。

  公开号：

  US20090264441A1

文献信息

• Compounds, Compositions and Methods Comprising Heteroaromatic Derivatives
  申请人：Doyle Kevin James

  公开号：US20090318429A1

  公开（公告）日：2009-12-24

  The present invention relates to compositions and methods for treating a disease in an animal, which disease is responsive to inhibiting of functional cystic fibrosis transmembrane conductance regulator (CFTR) polypeptide by administering to a mammal in need thereof an effective amount of a compound defined herein (including those compounds set forth in Tables 1-14 or encompassed by formulas I-XII) or compositions thereof, thereby treating the disease. The present invention particularly, relates to a method of treating diarrhea and polycystic kidney disease.

  本发明涉及用于治疗动物患病的组合物和方法，该疾病对通过向需要的哺乳动物投予本文所定义的化合物的有效量（包括表1-14中列出的那些化合物或被I-XII公式所包含的化合物）或其组合物来抑制功能性囊性纤维化跨膜传导调节蛋白（CFTR）多肽作出反应，从而治疗该疾病。本发明特别涉及一种治疗腹泻和多囊性肾病的方法。
• [EN] COMPOSITIONS AND METHODS COMPRISING OXADIAZOLE DERIVATIVES<br/>[FR] COMPOSITIONS ET PROCÉDÉS COMPRENANT DES DÉRIVÉS D'OXADIAZOLE
  申请人：DE HOSTOS EUGENIO L

  公开号：WO2014047212A1

  公开（公告）日：2014-03-27

  Provided herein are pharmaceutical compositions of compounds of Formula I, metabolites thereof, and pharmaceutically acceptable salts of each thereof containing an effective amount of the compound of Formula I, and methods of their use for treating diarrhea in humans.

  本文提供了化合物I的药物组合物，其代谢物以及每种药物学上可接受的盐，其中包含化合物I的有效量，并且提供了用于治疗人类腹泻的使用方法。
• Compounds, compositions and methods comprising heteroaromatic derivatives
  申请人：Doyle Kevin James

  公开号：US20100144733A1

  公开（公告）日：2010-06-10

  The present invention relates to compositions and methods for treating a disease in an animal, which disease is responsive to inhibiting of functional cystic fibrosis transmembrane conductance regulator (CFTR) polypeptide by administering to a mammal in need thereof an effective amount of a compound defined herein (including those compounds set forth in Tables 1-14 or encompassed by formulas I-XII) or compositions thereof, thereby treating the disease. The present invention particularly, relates to a method of treating diarrhea and polycystic kidney disease.

  本发明涉及用于治疗动物体内对抑制功能性囊性纤维化跨膜传导调节因子（CFTR）多肽敏感的疾病的组合物和方法，通过向需要治疗该疾病的哺乳动物中投与本文所定义的化合物的有效量（包括表1-14中列出的化合物或公式I-XII所包含的化合物）或其组合物，从而治疗该疾病。本发明特别涉及治疗腹泻和多囊肾病的方法。
• Compounds, compositions and methods comprising oxadiazole derivatives
  申请人：Institute for OneWorld Health

  公开号：US08207205B2

  公开（公告）日：2012-06-26

  The present invention relates to compositions and methods for treating a disease in an animal, which disease is responsive to inhibiting of functional cystic fibrosis transmembrane conductance regulator (CFTR) polypeptide by administering to a mammal in need thereof an effective amount of a compound defined herein (including those compounds set forth in Tables 1-2 or encompassed by formulas I-IV) or compositions thereof, thereby treating the disease. The present invention particularly, relates to a method of treating diarrhea and polycystic kidney disease.

  本发明涉及用于治疗动物中对抑制功能性囊性纤维化跨膜传导调节因子（CFTR）多肽有反应的疾病的组合物和方法，通过向需要治疗该疾病的哺乳动物中注射本文所定义的有效量的化合物（包括表1-2中列出的化合物或公式I-IV所包含的化合物）或其组合物，从而治疗该疾病。本发明特别涉及治疗腹泻和多囊肾病的方法。
• COMPOUNDS, COMPOSITIONS AND METHODS COMPRISING OXADIAZOLE DERIVATIVES
  申请人：PATH Drug Solutions

  公开号：EP2278879B1

  公开（公告）日：2016-06-15