2-Amino-4-(3,5-diacetyl-phenylamino)-1,6-dimethyl-pyrimidin-1-ium

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 2-Amino-4-(3,5-diacetyl-phenylamino)-1,6-dimethyl-pyrimidin-1-ium
• 英文别名: 1-[3-Acetyl-5-[(2-amino-1,6-dimethylpyrimidin-1-ium-4-yl)amino]phenyl]ethanone
• 化学式: C₁₆H₁₉N₄O₂
• 分子量: 299.352
• InChiKey: ZXIPHGZDAXPXBX-UHFFFAOYSA-O

计算性质

• 辛醇/水分配系数(LogP)：
  1.6
• 重原子数：
  22
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  89
• 氢给体数：
  2
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  2-Amino-4-(3,5-diacetyl-phenylamino)-1,6-dimethyl-pyrimidin-1-ium 在 sodium tetrahydroborate 作用下， 以 甲醇 为溶剂， 以96%的产率得到2-Amino-4-[3,5-bis-(1-hydroxy-ethyl)-phenylamino]-1,6-dimethyl-pyrimidin-1-ium
  参考文献：
  名称：

  Inhibition of HIV-1 nuclear import via schiff base formation with arylene bis(methylketone) compounds

  摘要：

  Arylene bis(methylketone) compounds specifically block nuclear translocation of the HIV-1 pre-integration complex by forming Schiff-base adducts with contiguous lysines within nuclear localization signal. (C) 2002 Published by Elsevier Science Ltd.

  DOI：

  10.1016/s0960-894x(02)00642-x

文献信息

• Compounds and methods of use to treat infectious diseases
  申请人：Bukrinsky I. Michael

  公开号：US20060014760A1

  公开（公告）日：2006-01-19

  The present invention concerns alkyl aryl carbonyl compounds that possess anti-infective activity. The compounds of the invention can be used to target specific nuclear localization signal, thereby blocking importation of specific proteins or molecular complex into the nucleus of a cell. The invention encompasses methods of use of such compounds for treatment or prevention of infectious diseases, such as parasitic and viral diseases, including, for example, malaria and acquired immunodeficiency syndrome. The use of the compounds to detect certain specific protein structures which are present in nuclear localization sequences is also taught.

  本发明涉及具有抗感染活性的烷基芳基羰基化合物。该发明的化合物可用于靶向特定的核定位信号，从而阻止特定蛋白质或分子复合物进入细胞核。本发明包括使用这些化合物治疗或预防传染病的方法，如寄生虫和病毒性疾病，包括例如疟疾和获得性免疫缺陷综合症。本发明还教授了使用这些化合物检测核定位序列中存在的某些特定蛋白质结构的方法。
• Compounds and Methods Used to Treat Infectious Diseases
  申请人：Bukrinsky Michael I.

  公开号：US20100137566A1

  公开（公告）日：2010-06-03

  The present invention concerns alkyl aryl carbonyl compounds that possess anti-infective activity. The compounds of the invention can be used to target specific nuclear localization signal, thereby blocking importation of specific proteins or molecular complex into the nucleus of a cell. The invention encompasses methods of use of such compounds for treatment or prevention of infectious diseases, such as parasitic and viral diseases, including, for example, malaria and acquired immunodeficiency syndrome. The use of the compounds to detect certain specific protein structures which are present in nuclear localization sequences is also taught.

  本发明涉及具有抗感染活性的烷基芳基羰基化合物。本发明的化合物可用于针对特定的核定位信号，从而阻止特定蛋白质或分子复合物进入细胞核。本发明涵盖了使用这些化合物治疗或预防传染病的方法，例如寄生虫和病毒性疾病，包括疟疾和获得性免疫缺陷综合症。本发明还教导了使用这些化合物检测存在于核定位序列中的某些特定蛋白质结构的方法。
• COMPOUNDS AND THEIR USE TO TREAT INFECTIOUS DISEASES
  申请人：THE PICOWER INSTITUTE FOR MEDICAL RESEARCH

  公开号：EP0865434B1

  公开（公告）日：2003-12-17
• US6297253B1
  申请人：——

  公开号：US6297253B1

  公开（公告）日：2001-10-02
• US6649797B2
  申请人：——

  公开号：US6649797B2

  公开（公告）日：2003-11-18