2-chloro-4-{1-methyl-7-(methyloxy)-8-[(2-methylpropyl)oxy]-3H-pyrazolo[3,4-c]isoquinolin-5-yl}phenol hydrochloride | 838855-75-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 2-chloro-4-{1-methyl-7-(methyloxy)-8-[(2-methylpropyl)oxy]-3H-pyrazolo[3,4-c]isoquinolin-5-yl}phenol hydrochloride
• 英文别名: 2-chloro-4-[7-methoxy-1-methyl-8-(2-methylpropoxy)-2H-pyrazolo[3,4-c]isoquinolin-5-yl]phenol;hydrochloride
• CAS: 838855-75-7
• 化学式: C₂₂H₂₂ClN₃O₃*ClH
• 分子量: 448.349
• InChiKey: UXDKCGWPPHNVJW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.91
• 重原子数：
  30
• 可旋转键数：
  5
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.27
• 拓扑面积：
  80.3
• 氢给体数：
  3
• 氢受体数：
  5

文献信息

• ANAPLASTIC LYMPHOMA KINASE MODULATORS AND METHODS OF USE
  申请人：Exelixis, Inc.

  公开号：EP1648455A2

  公开（公告）日：2006-04-26
• EP1648455A4
  申请人：——

  公开号：EP1648455A4

  公开（公告）日：2009-03-04
• [EN] ANAPLASTIC LYMPHOMA KINASE MODULATORS AND METHODS OF USE<br/>[FR] MODULATEURS DE LA PROTEINE ALK (ANAPLASTIC LYMPHOMA KINASE) ET LEURS METHODES D'UTILISATION
  申请人：EXELIXIS INC

  公开号：WO2005009389A2

  公开（公告）日：2005-02-03

  The present invention comprises compounds and pharmaceutical compositions comprising the compounds that are inhibitors of ALK. The invention also comprises methods of using the compounds and compositions to treat diseases mediated by ALK, including diseases such as cancer, immunological disorders, cardiovascular diseases, and other degenerative disorders.