8-[(E)-2-(2,3-二甲基-4-甲氧苯基)乙烯基]-1,3,7-三甲基-3,7-二氢-1H-嘌呤-2,6-二酮 | 155271-17-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 咪唑并嘧啶类
• 中文名称: 8-[(E)-2-(2,3-二甲基-4-甲氧苯基)乙烯基]-1,3,7-三甲基-3,7-二氢-1H-嘌呤-2,6-二酮
• 英文名称: (E)-8-(4-Methoxy-2,3-dimethylstyryl)caffeine
• 英文别名: 8-[(E)-2-(4-methoxy-2,3-dimethylphenyl)ethenyl]-1,3,7-trimethylpurine-2,6-dione
• CAS: 155271-17-3
• 化学式: C₁₉H₂₂N₄O₃
• 分子量: 354.409
• InChiKey: SDHWMROLJYZHCX-CSKARUKUSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.6
• 重原子数：
  26
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.32
• 拓扑面积：
  67.7
• 氢给体数：
  0
• 氢受体数：
  4

文献信息

• ANTIDEPRESSANT
  申请人：KYOWA HAKKO KOGYO CO., LTD.

  公开号：EP0628311A1

  公开（公告）日：1994-12-14

  An antidepressant containing an active ingredient comprising a xanthine derivative represented by general formule (I) or a pharmacologically acceptable salt thereof, wherein R¹, R² and R³ may be the same or different from one another and each represents hydrogen, lower alkyl, alkyl or propargyl; R⁴ represents cycloalkyl, -(CH₂)n-R⁵ (wherein R⁵ represents optionally substituted aryl or optionally substituted heterocyclic group, and n represents an integer of 0 to 4) of group (A) wherein Y¹ and Y² may be the same or different from each other and each represents hydrogen, fluorine or methyl, and Z represents optionally substituted aryl, group (B) (wherein R⁶ represents hydrogen, hydroxy, lower alkyl, lower alkoxy, halogen, nitro or amino, and m represents an integer of 1 to 3), or optionally substituted heterocyclic group; and X¹ and X² may be the same or different from each other and each represents O or S.

  一种含有活性成分的抗抑郁剂，其活性成分包含通式(I)所代表的黄嘌呤衍生物或其药理上可接受的盐，其中 R¹、R² 和 R³ 可以相同或彼此不同，且各自代表氢、低级烷基、烷基或丙炔基；R⁴ 代表(A)基团的环烷基、-(CH₂)n-R⁵（其中 R⁵ 代表任选取代的芳基或任选取代的杂环基团，且 n 代表 0 至 4 的整数），其中 Y¹ 和 Y² 可以相同或不同，且各自代表氢、氟或甲基，Z 代表任选取代的芳基、基团 (B)（其中 R⁶ 代表氢、羟基、低级烷基、低级烷氧基、卤素、硝基或氨基，m 代表 1 至 3 的整数）或任选取代的杂环基团；X¹ 和 X² 可以相同或不同，各自代表 O 或 S。
• Therapeutic agents for parkinson's disease
  申请人：KYOWA HAKKO KOGYO CO., Ltd.

  公开号：EP0590919B1

  公开（公告）日：1999-12-29
• Xanthine-Derivatives as Antidepressants
  申请人：KYOWA HAKKO KOGYO CO., LTD.

  公开号：EP0628311B1

  公开（公告）日：2002-04-24
• EXPANSION OF TUMOR INFILTRATING LYMPHOCYTES (TILS) WITH ADENOSINE A2A RECEPTOR ANTAGONISTS AND THERAPEUTIC COMBINATIONS OF TILS AND ADENOSINE A2A RECEPTOR ANTAGONISTS
  申请人：Iovance Biotherapeutics, Inc.

  公开号：US20210137930A1

  公开（公告）日：2021-05-13

  Methods of expanding tumor infiltrating lymphocytes (TILs) in the presence of an adenosine A2A receptor (A2aR) antagonist, such as vipadenant, CPI-444 (ciforadenant), SCH58261, SYN115, ZM241385, SCH420814, a xanthine superfamily A2aR antagonist, or related adenosine receptor 2A antagonist, and uses of expanded TILs in the treatment of diseases such as cancer are disclosed herein. In addition, therapeutic combinations of TILs and A2aR antagonists, including compositions and uses thereof in the treatment of diseases such as cancer are disclosed herein.
• US5484920A
  申请人：——

  公开号：US5484920A

  公开（公告）日：1996-01-16