N-(2,2-Dimethyl-3,4-dihydro-2H-benzo[1,4]oxazin-6-yl)-2-(4-fluoro-benzylamino)-nicotinamide | 442846-32-4

• 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: N-(2,2-Dimethyl-3,4-dihydro-2H-benzo[1,4]oxazin-6-yl)-2-(4-fluoro-benzylamino)-nicotinamide
• 英文别名: N-(2,2-dimethyl-3,4-dihydro-1,4-benzoxazin-6-yl)-2-[(4-fluorophenyl)methylamino]pyridine-3-carboxamide
• CAS: 442846-32-4
• 化学式: C₂₃H₂₃FN₄O₂
• 分子量: 406.46
• InChiKey: MRTQFEVTVFYJKE-UHFFFAOYSA-N

物化性质

• 沸点：
  520.4±50.0 °C(Predicted)
• 密度：
  1.277±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.5
• 重原子数：
  30
• 可旋转键数：
  5
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  75.3
• 氢给体数：
  3
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  N-(4-Acetyl-2,2-dimethyl-3,4-dihydro-2H-benzo[1,4]oxazin-6-yl)-2-(4-fluoro-benzylamino)-nicotinamide 、 碳酸氢钠 在 乙酸乙酯 、 Brine 、 Sodium sulfate-III 、 silica gel 、 EtOAc hexanes 作用下， 以 乙醇 为溶剂， 反应 16.0h， 生成 N-(2,2-Dimethyl-3,4-dihydro-2H-benzo[1,4]oxazin-6-yl)-2-(4-fluoro-benzylamino)-nicotinamide
  参考文献：
  名称：

  Substituted arylamine derivatives and methods of use

  摘要：

  所选化合物对于预防和治疗疾病，如血管生成介导的疾病具有有效性。该发明涵盖了新颖化合物、类似物、前药和其药学上可接受的衍生物、药物组合物以及用于预防和治疗涉及癌症等疾病和其他疾病或情况的方法。该发明还涉及制造这些化合物的过程以及在这些过程中有用的中间体。

  公开号：

  US20030134836A1

文献信息

• N-PYRIDYL CARBOXAMIDE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM
  申请人：Amgen Inc.

  公开号：EP1358161A2

  公开（公告）日：2003-11-05
• SUBSTITUTED BENZYLAMINE DERIVATIVES AND METHODS OF USE
  申请人：AMGEN INC.

  公开号：EP1583744A2

  公开（公告）日：2005-10-12
• US7101868B2
  申请人：——

  公开号：US7101868B2

  公开（公告）日：2006-09-05
• [EN] SUBSTITUTED ARYLAMINE DERIVATIVES AND METHODS OF USE<br/>[FR] DERIVES D'ARYLAMINE SUBSTITUES ET LEURS METHODES D'UTILISATION
  申请人：AMGEN INC

  公开号：WO2002055501A2

  公开（公告）日：2002-07-18

  Selected compounds of formula (I), wherein each of A?1 and A2¿ is independently C or N; wherein A1-A2 form part of a ring A selected from 5- or 6- membered heteroaryl; wherein X is; wherein Z is oxygen or sulfur; are effective for prophylaxis and treatment of diseases, such as angiogenesis mediated diseases. The invention encompasses novel compounds, analogs, prodrugs and pharmaceutically acceptable derivatives thereof, pharmaceutical compositions and methods for prophylaxis and treatment of diseases and other maladies or conditions involving, cancer and the like. The subject invention also relates to processes for making such compounds as well as to intermediates useful in such processes.
• [EN] SUBSTITUTED BENZYLAMINE DERIVATIVES AND METHODS OF USE<br/>[FR] DERIVES DE BENZYLAMINE SUBSTITUES ET PROCEDES D'UTILISATION
  申请人：AMGEN INC

  公开号：WO2004007457A2

  公开（公告）日：2004-01-22

  Selected compounds of formula (IV) are effective for prophylaxis and treatment of diseases, such as angiogenesis mediated diseases. The invention encompasses novel compounds, analogs, prodrugs and pharmaceutically acceptable derivatives thereof, pharmaceutical compositions and methods for prophylaxis and treatment of diseases and other maladies or conditions involving, cancer and the like. The subject invention also relates to processes for making such compounds as well as intermediates useful in such processes.