5-(4-chlorophenyl)-3-(2-hydroxyphenyl)-4,5-dihydroindeno[1,2-c][1,2]diazepin-6(1H)-one | 1390627-16-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪类
• 英文名称: 5-(4-chlorophenyl)-3-(2-hydroxyphenyl)-4,5-dihydroindeno[1,2-c][1,2]diazepin-6(1H)-one
• CAS: 1390627-16-3
• 化学式: C₂₄H₁₇ClN₂O₂
• 分子量: 400.864
• InChiKey: ZBDJLTMTDMJXNJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.13
• 重原子数：
  29.0
• 可旋转键数：
  2.0
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  61.69
• 氢给体数：
  2.0
• 氢受体数：
  4.0

反应信息

• 作为产物：
  描述：

  2-(1-(4-chlorophenyl)-3-(2-hydroxyphenyl)-3-oxopropyl)-2H-indene-1,3-dione 在 一水合肼 作用下， 反应 0.33h， 以89%的产率得到5-(4-chlorophenyl)-3-(2-hydroxyphenyl)-4,5-dihydroindeno[1,2-c][1,2]diazepin-6(1H)-one
  参考文献：
  名称：

  A Novel and Highly Efficient Protocol for the Synthesis of Chalcone Based 1,2-Diazepine and 1,2-Oxazepine Derivatives

  摘要：

  A novel and highly efficient protocol is described for the synthesis of chalcone based 1,2-diazepine and I,2-oxazepine derivatives. Under neat condition, the mixing and grinding of 1,5-diketones and hydrazine gave the cyclocondensation products in quantitative yields within 10-20 min at room temperature. Similarly, novel chalcone based 1,2-oxazepines were synthesized in excellent yields (85-88%) in 2-3 h at refluxed by the condensation of 1,5-diktones and hydroxylamine hydrochloride in water-ethanolic base.

  DOI：

  10.3987/com-12-12444