4-(5-Phenyl-pentyloxy)-phenylamine | 101581-81-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: 4-(5-Phenyl-pentyloxy)-phenylamine
• 英文别名: 4-(5-Phenylpentoxy)aniline
• CAS: 101581-81-1
• 化学式: C₁₇H₂₁NO
• 分子量: 255.36
• InChiKey: BAZUHWJRAFZYRD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  19
• 可旋转键数：
  7
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.29
• 拓扑面积：
  35.2
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  4-(5-Phenyl-pentyloxy)-phenylamine 、 N,N'-硫羰基二咪唑 以 二氯甲烷 为溶剂， 反应 1.0h， 生成
  参考文献：
  名称：

  Design, synthesis, and anti-HCV activity of thiourea compounds

  摘要：

  A series of thiourea derivatives were synthesized and their antiviral activity was evaluated in a cell-based HCV subgenomic replicon assay. SAR studies revealed that the chain length and the position of the alkyl linker largely influenced the in vitro anti-HCV activity of this class of potent antiviral agents. Among this series of compounds synthesized, the thiourea derivative with a six-carbon alkyl linker at the meta-position of the central phenyl ring (10) was identified as the most potent anti-HCV inhibitor (EC50 = 0.047 mu M) with a selectivity index of 596. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2009.02.048
• 作为产物：
  描述：

  1-Nitro-4-(5-phenylpentoxy)benzene 在 tin(II) chloride dihdyrate 作用下， 以 乙醇 为溶剂， 生成 4-(5-Phenyl-pentyloxy)-phenylamine
  参考文献：
  名称：

  Design, synthesis, and anti-HCV activity of thiourea compounds

  摘要：

  A series of thiourea derivatives were synthesized and their antiviral activity was evaluated in a cell-based HCV subgenomic replicon assay. SAR studies revealed that the chain length and the position of the alkyl linker largely influenced the in vitro anti-HCV activity of this class of potent antiviral agents. Among this series of compounds synthesized, the thiourea derivative with a six-carbon alkyl linker at the meta-position of the central phenyl ring (10) was identified as the most potent anti-HCV inhibitor (EC50 = 0.047 mu M) with a selectivity index of 596. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2009.02.048