10,12-dibromo-6-chloroacetylphthalazino[1,2-b]quinazoline-5,8-dione | 1240505-59-2

• 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: 10,12-dibromo-6-chloroacetylphthalazino[1,2-b]quinazoline-5,8-dione
• 英文别名: 10,12-dibromo-6-(2-chloroacetyl)quinazolino[2,3-a]phthalazine-5,8-dione
• CAS: 1240505-59-2
• 化学式: C₁₇H₈Br₂ClN₃O₃
• 分子量: 497.53
• InChiKey: QVPYLWDYWLJMDZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.7
• 重原子数：
  26
• 可旋转键数：
  1
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.06
• 拓扑面积：
  70
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  10,12-dibromo-6-chloroacetylphthalazino[1,2-b]quinazoline-5,8-dione 、 丙二酸二乙酯 在 sodium ethanolate 作用下， 以 乙醇 为溶剂， 反应 3.0h， 以69%的产率得到10,12-dibromo-6-[3,3-di(ethoxycarbonyl)propionyl]phthalazino[1,2-b]quinazoline-5,8-dione
  参考文献：
  名称：

  Synthesis of some quinazolines derived from 6,8-dibromo2-(2-carboxyphenyl)-4h-3,1-benzoxazin-4-one as antimicrobial agents

  摘要：

  The reactivity of 6,8-dibromo-2-(2-carboxyphenyl)-4H-3,1-benzoxazin-4-one towards the action of electrophilic and nucleophilic reagents led to the direct formation of heterobicyclic nitrogen compounds. The antimicrobial activity of some synthesized compounds was investigated.

  DOI：

  10.1007/s10593-010-0459-4
• 作为产物：
  描述：

  3-amino-6,8-dibromo-2-(2-carboxyphenyl)-4(3H)-quinazolin-4-one 、 氯乙酸乙酯 以 正丁醇 为溶剂， 反应 3.0h， 以60%的产率得到10,12-dibromo-6-chloroacetylphthalazino[1,2-b]quinazoline-5,8-dione
  参考文献：
  名称：

  Synthesis of some quinazolines derived from 6,8-dibromo2-(2-carboxyphenyl)-4h-3,1-benzoxazin-4-one as antimicrobial agents

  摘要：

  The reactivity of 6,8-dibromo-2-(2-carboxyphenyl)-4H-3,1-benzoxazin-4-one towards the action of electrophilic and nucleophilic reagents led to the direct formation of heterobicyclic nitrogen compounds. The antimicrobial activity of some synthesized compounds was investigated.

  DOI：

  10.1007/s10593-010-0459-4

文献信息

• Synthesis of some quinazolines derived from 6,8-dibromo2-(2-carboxyphenyl)-4h-3,1-benzoxazin-4-one as antimicrobial agents
  作者：I. F. Nassar

  DOI：10.1007/s10593-010-0459-4

  日期：2009.12

  The reactivity of 6,8-dibromo-2-(2-carboxyphenyl)-4H-3,1-benzoxazin-4-one towards the action of electrophilic and nucleophilic reagents led to the direct formation of heterobicyclic nitrogen compounds. The antimicrobial activity of some synthesized compounds was investigated.