6-(3-hydroxy-4-(pyrrolidinomethyl)phenylmethyl)-3-isopropyl-1-(3,5-dichloropyridin-4-yl)pyrazolo[3,4-d]pyrimidin-4-one | 1089182-60-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡唑并吡啶类
• 英文名称: 6-(3-hydroxy-4-(pyrrolidinomethyl)phenylmethyl)-3-isopropyl-1-(3,5-dichloropyridin-4-yl)pyrazolo[3,4-d]pyrimidin-4-one
• 英文别名: 1-(3,5-dichloropyridin-4-yl)-6-[[3-hydroxy-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-3-propan-2-yl-5H-pyrazolo[3,4-d]pyrimidin-4-one
• CAS: 1089182-60-4
• 化学式: C₂₅H₂₆Cl₂N₆O₂
• 分子量: 513.426
• InChiKey: IMSSCOBTCAGTOA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  35
• 可旋转键数：
  6
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  95.6
• 氢给体数：
  2
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  6-(3-hydroxy-4-(pyrrolidinomethyl)phenylmethyl)-3-isopropyl-1-(3,5-dichloropyridin-4-yl)pyrazolo[3,4-d]pyrimidin-4-one 、 顺丁烯二酸 以 异丙醇 为溶剂， 反应 0.33h， 生成 6-(3-hydroxy-4-(pyrrolidinomethyl)phenylmethyl)-3-isopropyl-1-(3,5-dichloropyridin-4-yl)pyrazolo[3,4-d]pyrimidin-4-one, maleic acid saltate
  参考文献：
  名称：

  WO2008/145678

  摘要：

  公开号：

文献信息

• PYRAZOLOPYRIMIDINONE KINASE INHIBITOR
  申请人：Kluge Arthur F.

  公开号：US20100160350A1

  公开（公告）日：2010-06-24

  The present invention provides a novel pyrazolo[3,4-d]pyrimidin-4-one, specifically a derivative of 1-(pyridine-4-yl)-pyrazolo[3,4-d]pyrimidin-4-one. This compound is a kinase inhibitor that shows unexpected anti-proliferative activity against cells, including against tumor cells, and anti-tumor activity in xenograft tumor models. The compound or a suitable salt or prodrug thereof is useful for the treatment of individuals suffering from a cancer or another proliferative disorder or disease.

  本发明提供了一种新型的吡唑并[3,4-d]嘧啶-4-酮，具体是1-(吡啶-4-基)-吡唑并[3,4-d]嘧啶-4-酮的衍生物。该化合物是一种激酶抑制剂，对细胞，包括肿瘤细胞表现出意外的抗增殖活性，并在异种移植瘤模型中表现出抗肿瘤活性。该化合物或其适当的盐或前药对于治疗患有癌症或其他增生性疾病的个体是有用的。
• Pyrazol[3,4-d]pyrimidin-4-one useful as Kinase Inhibitor
  申请人：GPC Biotech AG

  公开号：EP2019101A1

  公开（公告）日：2009-01-28

  The present invention provides a novel pyrazolo[3,4-d]pyrimidin-4-one of formula (I), specifically a derivative of 1-(pyridin-4-yl)-pyrazolo[3,4-d]pyrimidin-4-one. This compound is a kinase inhibitor that shows unexpected anti-proliferative activity against cells, including against tumor cells, and anti-tumor activity in xenograft tumor models. The compound or a suitable salt or prodrug thereof is useful for the treatment of individuals suffering from a cancer or another proliferative disorder or disease.

  本发明提供了一种新型的式(I)吡唑并[3,4-d]嘧啶-4-酮，特别是 1-(吡啶-4-基)-吡唑并[3,4-d]嘧啶-4-酮的衍生物。该化合物是一种激酶抑制剂，对细胞（包括肿瘤细胞）具有意想不到的抗增殖活性，在异种移植肿瘤模型中具有抗肿瘤活性。该化合物或其适当的盐或原药可用于治疗癌症或其他增殖性紊乱或疾病患者。
• US8304418B2
  申请人：——

  公开号：US8304418B2

  公开（公告）日：2012-11-06
• [EN] PYRAZOLOPYRIMIDINONE KINASE INHIBITOR<br/>[FR] INHIBITEUR DE PYRAZOLOPYRIMIDINONE KINASES
  申请人：GPC BIOTECH AG

  公开号：WO2008145678A1

  公开（公告）日：2008-12-04

  [EN] The present invention provides a novel pyrazolo[3,4-d]pyrimidin-4-one, specifically a derivative of 1-(pyridin-4-yl)-pyrazolo[3,4-d]pyrimidin-4-one. This compound is a kinase inhibitor that shows unexpected anti-proliferative activity against cells, including against tumor cells, and anti-tumor activity in xenograft tumor models. The compound or a suitable salt or prodrug thereof is useful for the treatment of individuals suffering from a cancer or another proliferative disorder or disease.
  [FR] L'invention concerne un nouveau composé de pyrazolo[3,4-d]pyrimidin-4-one, spécifiquement un dérivé de 1-(pyridin-4-yl)-pyrazolo[3,4-d]pyrimidin-4-one. Ce composé constitue un inhibiteur de kinases qui présente une activité antiproliférante inattendue contre certaines cellules, y compris des cellules tumorales, et une activité antitumorale dans des modèles de tumeur de xénogreffe. Ce composé, ou un sel ou un promédicament approprié de celui-ci, est utile pour traiter des sujets atteints d'un cancer ou d'un autre trouble proliférant ou d'une autre maladie proliférante.