N-ethyl-4-(diphenylmethyl)piperazine-1-carboxamide | 1581258-91-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: N-ethyl-4-(diphenylmethyl)piperazine-1-carboxamide
• 英文别名: 4-benzhydryl-N-ethylpiperazine-1-carboxamide
• CAS: 1581258-91-4
• 化学式: C₂₀H₂₅N₃O
• 分子量: 323.438
• InChiKey: LFNJUPYTEGCDQJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  24
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.35
• 拓扑面积：
  35.6
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  二苯氯甲烷 在 potassium carbonate 、 三乙胺 作用下， 以 二氯甲烷 、 N,N-二甲基甲酰胺 为溶剂， 反应 8.34h， 生成 N-ethyl-4-(diphenylmethyl)piperazine-1-carboxamide
  参考文献：
  名称：

  Synthesis and cytotoxicity studies of novel benzhydrylpiperazine carboxamide and thioamide derivatives

  摘要：

  Synthesis and cytotoxic activities of 32 benzhydrylpiperazine derivatives with carboxamide and thioamide moieties were reported. In vitro cytotoxic activities of compounds were screened against hepatocellular (HUH-7), breast (MCF-7) and colorectal (HCT-116) cancer cell lines by sulphorhodamine B assay. In general, 4-chlorobenzhydrylpiperazine derivatives were more cytotoxic than other compounds. In addition, thioamide derivatives (6a-g) have higher growth inhibition than their carboxamide analogs.

  DOI：

  10.3109/14756366.2013.765416