4-[5-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-3-yl]-3-(4-fluorophenyl)-1-phenyl-pyrazole | 1395100-84-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 4-[5-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-3-yl]-3-(4-fluorophenyl)-1-phenyl-pyrazole
• 英文别名: 4-[5-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-3-yl]-3-(4-fluorophenyl)-1-phenylpyrazole
• CAS: 1395100-84-1
• 化学式: C₂₄H₁₈ClFN₄
• 分子量: 416.885
• InChiKey: YESOBPZQZHEIHN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.7
• 重原子数：
  30
• 可旋转键数：
  4
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  42.2
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  1-(4-chlorophenyl)-3-(3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl)prop-2-en-1-one 在 一水合肼 、 溶剂黄146 作用下， 以 乙醇 为溶剂， 反应 0.25h， 以81%的产率得到4-[5-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-3-yl]-3-(4-fluorophenyl)-1-phenyl-pyrazole
  参考文献：
  名称：

  Green synthesis and anti-infective activities of fluorinated pyrazoline derivatives

  摘要：

  A new series of fluorinated pyrazoles, 4a-e, were synthesized in good to excellent overall yields (65-82%) from the corresponding chalcones, 3a-e, by ultrasonic irradiation. The newly synthesized compounds were characterized and screened for their in vitro anti-bacterial, anti-fungal, and anti-tubercular activities against Mycobacterium tuberculosis H(37)Rv. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2012.06.072

文献信息

• Green synthesis and anti-infective activities of fluorinated pyrazoline derivatives
  作者：Sharad N. Shelke、Ganesh R. Mhaske、Vasco D.B. Bonifácio、Manoj B. Gawande

  DOI：10.1016/j.bmcl.2012.06.072

  日期：2012.9

  A new series of fluorinated pyrazoles, 4a-e, were synthesized in good to excellent overall yields (65-82%) from the corresponding chalcones, 3a-e, by ultrasonic irradiation. The newly synthesized compounds were characterized and screened for their in vitro anti-bacterial, anti-fungal, and anti-tubercular activities against Mycobacterium tuberculosis H(37)Rv. (C) 2012 Elsevier Ltd. All rights reserved.