N-(4,6-dimethylpyridin-2-yl)-3-(4-diphenylmethylpiperazin-1-yl)propanamide

• 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-(4,6-dimethylpyridin-2-yl)-3-(4-diphenylmethylpiperazin-1-yl)propanamide
• 英文别名: 3-(4-benzhydrylpiperazin-1-yl)-N-(4,6-dimethylpyridin-2-yl)propanamide
• 化学式: C₂₇H₃₂N₄O
• 分子量: 428.577
• InChiKey: FUCDCSAKFIBDPM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.1
• 重原子数：
  32
• 可旋转键数：
  7
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  48.5
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  2-氨基-4,6-二甲基吡啶 在 TEA 作用下， 以 二氯甲烷 、 甲苯 为溶剂， 反应 6.0h， 生成 N-(4,6-dimethylpyridin-2-yl)-3-(4-diphenylmethylpiperazin-1-yl)propanamide
  参考文献：
  名称：

  Synthesis and antiallergic activity of N-(pyridin-2-yl)-3-(piperazin-1-yl) propanamides

  摘要：

  A series of 6 new N-(pyridin-2-yl)-3-(piperazin-1-yl)propanamides were synthesized from the corresponding N-pyridinylpropenamides to determine potential antiallergic activity as assayed in vivo by the passive cutaneous anaphylaxis test. The IC50 of compound 12 after oral administration was comparable to that of oxatomide.

  DOI：

  10.1016/0223-5234(93)90117-w

文献信息

• Courant J., Leblois D., Le Baut G., Venco C., Panconi E., Eur. J. Med. Chem, 28 (1993) N 10, S 821-824
  作者：Courant J., Leblois D., Le Baut G., Venco C., Panconi E.

  DOI：——

  日期：——
• Synthesis and antiallergic activity of N-(pyridin-2-yl)-3-(piperazin-1-yl) propanamides
  作者：J Courant、D Leblois、G Le Baut、C Venco、E Panconi

  DOI：10.1016/0223-5234(93)90117-w

  日期：1993.1

  A series of 6 new N-(pyridin-2-yl)-3-(piperazin-1-yl)propanamides were synthesized from the corresponding N-pyridinylpropenamides to determine potential antiallergic activity as assayed in vivo by the passive cutaneous anaphylaxis test. The IC50 of compound 12 after oral administration was comparable to that of oxatomide.