3-[(2-aminophenylsulfanyl)(phenyl)methylamino]-6,8-dibromo-2-(2-carboxyphenyl)quinazolin-4-one | 1240505-46-7

• 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: 3-[(2-aminophenylsulfanyl)(phenyl)methylamino]-6,8-dibromo-2-(2-carboxyphenyl)quinazolin-4-one
• 英文别名: 2-[3-[[(2-Aminophenyl)sulfanyl-phenylmethyl]amino]-6,8-dibromo-4-oxoquinazolin-2-yl]benzoic acid
• CAS: 1240505-46-7
• 化学式: C₂₈H₂₀Br₂N₄O₃S
• 分子量: 652.366
• InChiKey: WHFRODMOTXLGEJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.1
• 重原子数：
  38
• 可旋转键数：
  7
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.04
• 拓扑面积：
  133
• 氢给体数：
  3
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  3-[(2-aminophenylsulfanyl)(phenyl)methylamino]-6,8-dibromo-2-(2-carboxyphenyl)quinazolin-4-one 、 苯甲酰氯 反应 1.0h， 以43%的产率得到3-[(2-benzoylaminophenylsulfanyl)(phenyl)methylamino]-6,8-dibromo-2-(2-carboxyphenyl)quinazolin-4-one
  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-benzylideneamino-6,8-dibromo-2-(2-carboxyphenyl)quinazolin-4-one 、 2-氨基苯硫醇 在 哌啶 作用下， 以 苯 为溶剂， 反应 3.0h， 以38%的产率得到3-[(2-aminophenylsulfanyl)(phenyl)methylamino]-6,8-dibromo-2-(2-carboxyphenyl)quinazolin-4-one
  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.