1-[1-(3,3-Dimethyl-butyl)-4-oxo-3,4-dihydro-phthalazin-6-yl]-3-(3-trifluoromethyl-phenyl)-urea | 497255-46-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二氮杂萘
• 英文名称: 1-[1-(3,3-Dimethyl-butyl)-4-oxo-3,4-dihydro-phthalazin-6-yl]-3-(3-trifluoromethyl-phenyl)-urea
• 英文别名: 1-[1-(3,3-dimethylbutyl)-4-oxo-3H-phthalazin-6-yl]-3-[3-(trifluoromethyl)phenyl]urea
• CAS: 497255-46-6
• 化学式: C₂₂H₂₃F₃N₄O₂
• 分子量: 432.445
• InChiKey: KFUYJVMFONEXBQ-UHFFFAOYSA-N

物化性质

• 密度：
  1.30±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.5
• 重原子数：
  31
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.32
• 拓扑面积：
  82.6
• 氢给体数：
  3
• 氢受体数：
  6

文献信息

• 4-amino-thieno[3,2-c] pyridine-7-carboxylic acid derivatives
  申请人：Bartkovitz Joseph David

  公开号：US20070060607A1

  公开（公告）日：2007-03-15

  The present invention relates to compounds of the formula medicaments containing them and the use of these compounds as pharmaceutically active agents. The compounds exhibit activity as Raf kinase inhibitors and therefore may be useful for the treatment of diseases mediated by said kinases, especially as anticancer agents.

  本发明涉及公式化合物、含有它们的药物以及将这些化合物用作药用活性剂的用途。这些化合物表现出作为Raf激酶抑制剂的活性，因此可能对通过该激酶介导的疾病的治疗有用，特别是作为抗癌剂。
• Amino-phthalazinone derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions containing them
  申请人：PHARMACIA & UPJOHN S.p.A.

  公开号：US20030073692A1

  公开（公告）日：2003-04-17

  Compounds which are amino-phthalazinone derivatives and pharmaceutically acceptable salts thereof, together with pharmaceutical compositions comprising them are disclosed; these compounds or compositions are useful in the treatment of diseases caused by and/or associated with an altered protein kinase activity such as cancer, cell proliferative disorders, Alzheimer's disease, viral infections, auto-immune diseases and neurodegenerative disorders.

  本文揭示了一种氨基-邻苯二氮酮衍生物及其药学上可接受的盐，以及包含它们的制药组合物；这些化合物或组合物在治疗由于和/或与蛋白激酶活性改变有关的疾病方面具有用处，例如癌症、细胞增殖性疾病、阿尔茨海默病、病毒感染、自身免疫性疾病和神经退行性疾病。
• AMINO-PHTHALAZINONE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM
  申请人：Pharmacia Italia S.p.A.

  公开号：EP1427708A1

  公开（公告）日：2004-06-16
• AMINO-PHTHALAZINONE DERIVATIVES AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM
  申请人：Pfizer Italia S.r.l.

  公开号：EP1427708B1

  公开（公告）日：2008-09-10
• 4-AMINO-THIENO[3,2-C]PYRIDINE-7-CARBOXYLIC ACID DERIVATIVES
  申请人：F.HOFFMANN-LA ROCHE AG

  公开号：EP1926737A1

  公开（公告）日：2008-06-04