(5-{3-[4-(2-bromo-5-fluorophenoxy)-2-chlorophenyl]isoxazol-5-yl}-2H-tetrazol-2-yl)acetic acid | 1161025-84-8

• 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: (5-{3-[4-(2-bromo-5-fluorophenoxy)-2-chlorophenyl]isoxazol-5-yl}-2H-tetrazol-2-yl)acetic acid
• 英文别名: 2-[5-[3-[4-(2-Bromo-5-fluorophenoxy)-2-chlorophenyl]-1,2-oxazol-5-yl]tetrazol-2-yl]acetic acid
• CAS: 1161025-84-8
• 化学式: C₁₈H₁₀BrClFN₅O₄
• 分子量: 494.664
• InChiKey: UWCKVFPRVKOKQL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.6
• 重原子数：
  30
• 可旋转键数：
  6
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.06
• 拓扑面积：
  116
• 氢给体数：
  1
• 氢受体数：
  9

文献信息

• [EN] NOVEL HETEROAROMATIC COMPOUNDS AS INHIBITORS OF STEAROYL-COENZYME A DELTA-9 DESATURASE<br/>[FR] NOUVEAUX COMPOSÉS HÉTÉROAROMATIQUES EN TANT QU'INHIBITEURS DE LA COENZYME STÉAROYLE A DELTA-9 DÉSATURASE
  申请人：MERCK FROSST CANADA LTD

  公开号：WO2009073973A1

  公开（公告）日：2009-06-18

  Heteroaromatic compounds of structural formula I are inhibitors of stearoyl-coenzyme A delta-9 desaturase (SCD). The compounds of the present invention are useful for the prevention and treatment of conditions related to abnormal lipid synthesis and metabolism, including cardiovascular disease; atherosclerosis; obesity; diabetes; neurological disease; Metabolic Syndrome; insulin resistance; cancer; liver steatosis; and non-alcoholic steatohepatitis. HetAr_W_X_Ar (I)

  结构式 I 的杂环芳香化合物是硬脂酰辅酶 A 三十九去饱和酶（SCD）的抑制剂。本发明的化合物可用于预防和治疗与异常脂质合成和代谢相关的疾病，包括心血管疾病；动脉粥样硬化；肥胖症；糖尿病；神经系统疾病；代谢综合征；胰岛素抵抗；癌症；肝脂肪变性；以及非酒精性脂肪肝炎。HetAr_W_X_Ar (I)
• NOVEL HETEROAROMATIC COMPOUNDS AS INHIBITORS OF STEAROYL-COENZYME A DELTA-9 DESATURASE
  申请人：Li Chun Sing

  公开号：US20100249192A1

  公开（公告）日：2010-09-30

  Heteroaromatic compounds of structural formula I are inhibitors of stearoyl-coenzyme A delta-9 desaturase (SCD). The compounds of the present invention are useful for the prevention and treatment of conditions related to abnormal lipid synthesis and metabolism, including cardiovascular disease; atherosclerosis; obesity; diabetes; neurological disease; Metabolic Syndrome; insulin resistance; cancer; liver steatosis; and non-alcoholic steatohepatitis. HetAr − W − X − Ar  (I)

  结构式I的杂环芳香化合物是硬脂酰辅酶A Delta-9去饱和酶（SCD）的抑制剂。本发明的化合物可用于预防和治疗与异常脂质合成和代谢有关的疾病，包括心血管疾病；动脉粥样硬化；肥胖症；糖尿病；神经系统疾病；代谢综合征；胰岛素抵抗；癌症；肝脂肪变性和非酒精性脂肪肝。HetAr−W−X−Ar  （I）