2-(3,5-bis(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl)-5-bromopyrimidine | 1400674-03-4

• 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: 2-(3,5-bis(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl)-5-bromopyrimidine
• 英文别名: 2-[3,5-Bis(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]-5-bromopyrimidine；2-[3,5-bis(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]-5-bromopyrimidine
• CAS: 1400674-03-4
• 化学式: C₁₉H₁₃BrCl₂N₄
• 分子量: 448.149
• InChiKey: HXBHIYATCMZFAD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.6
• 重原子数：
  26
• 可旋转键数：
  3
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  41.4
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  1,3-bis(4-chlorophenyl)prop-2-en-1-one 、 5-溴-2-肼基嘧啶 在 溶剂黄146 作用下， 反应 0.09h， 以84%的产率得到2-(3,5-bis(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl)-5-bromopyrimidine
  参考文献：
  名称：

  Synthesis, characterization and pharmacological study of 4,5-dihydropyrazolines carrying pyrimidine moiety

  摘要：

  A series of 5-bromo-2-(3,5-diaryl-4,5-dihydro-1H-Pyrazol-1-yl)pyrimidine were prepared under conventional heating as well as microwave reaction condition. The newly synthesized compounds were characterized on the basis of elemental, spectral and single crystal X-ray studies. These new compounds were screened for their antioxidant, anti-inflammatory and analgesic activities. Some of these compounds exhibited potent biological activities compared to the standard drug. (C) 2012 Elsevier Masson SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2012.07.002

文献信息

• Synthesis, characterization and pharmacological study of 4,5-dihydropyrazolines carrying pyrimidine moiety
  作者：Adithya Adhikari、Balakrishna Kalluraya、Kizhakke Veedu Sujith、Kuluvar Gouthamchandra、Ravikumar Jairam、Riaz Mahmood、Ravish Sankolli

  DOI：10.1016/j.ejmech.2012.07.002

  日期：2012.9

  A series of 5-bromo-2-(3,5-diaryl-4,5-dihydro-1H-Pyrazol-1-yl)pyrimidine were prepared under conventional heating as well as microwave reaction condition. The newly synthesized compounds were characterized on the basis of elemental, spectral and single crystal X-ray studies. These new compounds were screened for their antioxidant, anti-inflammatory and analgesic activities. Some of these compounds exhibited potent biological activities compared to the standard drug. (C) 2012 Elsevier Masson SAS. All rights reserved.