4-[4-Ethyl-2,5-bis-(4-methoxy-phenyl)-furan-3-yl]-phenol | 386748-06-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: 4-[4-Ethyl-2,5-bis-(4-methoxy-phenyl)-furan-3-yl]-phenol
• 英文别名: 4-[4-Ethyl-2,5-bis(4-methoxyphenyl)furan-3-yl]phenol；4-[4-ethyl-2,5-bis(4-methoxyphenyl)furan-3-yl]phenol
• CAS: 386748-06-7
• 化学式: C₂₆H₂₄O₄
• 分子量: 400.474
• InChiKey: CAZLTTGQCFDWPP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.3
• 重原子数：
  30
• 可旋转键数：
  6
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.15
• 拓扑面积：
  51.8
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  4-[4-Ethyl-2,5-bis-(4-methoxy-phenyl)-furan-3-yl]-phenol 在 aluminum tri-bromide 、 偶氮二甲酸二异丙酯 、 三苯基膦 、 乙硫醇 作用下， 以 四氢呋喃 为溶剂， 生成 4-{5-(4-Hydroxy-phenyl)-4-ethyl-3-[4-(2-piperidin-1-yl-ethoxy)-phenyl]-furan-2-yl}-phenol
  参考文献：
  名称：

  Furans with basic side chains: synthesis and biological evaluation of a novel series of antagonists with selectivity for the estrogen receptor alpha

  摘要：

  3-Alkyl-2,4,5-triarylfurans with basic side-chain substituents were prepared as ligands for the estrogen receptor. Those analogues having the basic side chain on the C(4) phenol were high-affinity, ER alpha -selective antagonists. (C) 2001 Published by Elsevier Science Ltd.

  DOI：

  10.1016/s0960-894x(01)00488-7
• 作为产物：
  描述：

  1-(4-甲氧基苯基)-1-氧代-2-溴丁烷 在 双(三甲基硅烷基)氨基钾 、 对甲苯磺酸 作用下， 以 甲苯 为溶剂， 生成 4-[4-Ethyl-2,5-bis-(4-methoxy-phenyl)-furan-3-yl]-phenol
  参考文献：
  名称：

  Furans with basic side chains: synthesis and biological evaluation of a novel series of antagonists with selectivity for the estrogen receptor alpha

  摘要：

  3-Alkyl-2,4,5-triarylfurans with basic side-chain substituents were prepared as ligands for the estrogen receptor. Those analogues having the basic side chain on the C(4) phenol were high-affinity, ER alpha -selective antagonists. (C) 2001 Published by Elsevier Science Ltd.

  DOI：

  10.1016/s0960-894x(01)00488-7

文献信息

• Furans with basic side chains: synthesis and biological evaluation of a novel series of antagonists with selectivity for the estrogen receptor alpha
  作者：Deborah S. Mortensen、Alice L. Rodriguez、Jun Sun、Benita S. Katzenellenbogen、John A. Katzenellenbogen

  DOI：10.1016/s0960-894x(01)00488-7

  日期：2001.9

  3-Alkyl-2,4,5-triarylfurans with basic side-chain substituents were prepared as ligands for the estrogen receptor. Those analogues having the basic side chain on the C(4) phenol were high-affinity, ER alpha -selective antagonists. (C) 2001 Published by Elsevier Science Ltd.