N-[(1R)-1-[3-(4-ethoxyphenyl)imidazo[1,2-a]pyrimidin-2-yl]ethyl]-N-(2-ethylsulfonylethyl)-2-[4-fluoro-3-(trifluoromethyl)phenyl]acetamide | 918421-78-0

• 分子结构分类: 有机化合物 - 有机杂环化合物
• 英文名称: N-[(1R)-1-[3-(4-ethoxyphenyl)imidazo[1,2-a]pyrimidin-2-yl]ethyl]-N-(2-ethylsulfonylethyl)-2-[4-fluoro-3-(trifluoromethyl)phenyl]acetamide
• CAS: 918421-78-0
• 化学式: C₂₉H₃₀F₄N₄O₄S
• 分子量: 606.641
• InChiKey: AXSGMFGOFBMJQZ-LJQANCHMSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.2
• 重原子数：
  42
• 可旋转键数：
  11
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.34
• 拓扑面积：
  102
• 氢给体数：
  0
• 氢受体数：
  10

文献信息

• Aryl nitrile compounds and compositions and their uses in treating inflammatory and related disorders
  申请人：Bergeron Philippe

  公开号：US20070015773A1

  公开（公告）日：2007-01-18

  Compounds, compositions and methods that are useful in the treatment of inflammatory and immune conditions and diseases are provided herein. In particular, the invention provides aryl nitrile compounds which modulate the expression and/or function of a chemokine receptor. The subject methods are useful for the treatment of inflammatory and immunoregulatory disorders and diseases, such as multiple sclerosis, rheumatoid arthritis, type I diabetes, asthma, psoriasis and inflammatory bowel disease.

  本文提供了在治疗炎症和免疫相关疾病中有用的化合物、组合物和方法。具体来说，本发明提供了可以调节趋化因子受体的表达和/或功能的芳基腈化合物。这些方法适用于治疗炎症和免疫调节性疾病，例如多发性硬化症、类风湿性关节炎、1型糖尿病、哮喘、牛皮癣和炎症性肠病。
• US7799795B2
  申请人：——

  公开号：US7799795B2

  公开（公告）日：2010-09-21
• [EN] ARYL NITRILE COMPOUNDS AND COMPOSITIONS AND THEIR USES IN TREATING INFLAMMATORY AND RELATED DISORDERS<br/>[FR] COMPOSES ET COMPOSITIONS D'ARYL NITRILE ET LEURS UTILISATIONS DANS LE TRAITEMENT DE MALADIES INFLAMMATOIRES ET DE TROUBLES ASSOCIES
  申请人：AMGEN INC

  公开号：WO2007002701A2

  公开（公告）日：2007-01-04

  [EN] Compounds, compositions and methods that are useful in the treatment of inflammatory and immune conditions and diseases are provided herein. In particular, the invention provides aryl nitrile compounds which modulate the expression and/or function of a chemokine receptor. The subject methods are useful for the treatment of inflammatory and immunoregulatory disorders and diseases, such as multiple sclerosis, rheumatoid arthritis, type I diabetes, asthma, psoriasis and inflammatory bowel disease.
  [FR] L'invention concerne des composés, des compositions et des procédés qui sont utilisés dans le traitement d'états et de maladies inflammatoires et immunes. En particulier, l'invention concerne des composés aryl nitrile qui modulent l'expression et/ou la fonction d'un récepteur de chimiokine. Les procédés selon l'invention sont utilisés pour le traitement de troubles et de maladies inflammatoires et immunorégulateurs tels que sclérose en plaques, polyarthrite rhumatoïde, diabète de type I, asthme, psoriasis et maladies intestinales inflammatoires.