[4-[2-[2-[4-(5-Formyl-2-methoxyphenoxy)-2-methoxyphenyl]ethyl]-4-methoxyphenyl]-3-methoxyphenyl]methyl-triphenylphosphanium;bromide | 1415228-96-4

• 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: [4-[2-[2-[4-(5-Formyl-2-methoxyphenoxy)-2-methoxyphenyl]ethyl]-4-methoxyphenyl]-3-methoxyphenyl]methyl-triphenylphosphanium;bromide
• 英文别名: [4-[2-[2-[4-(5-formyl-2-methoxyphenoxy)-2-methoxyphenyl]ethyl]-4-methoxyphenyl]-3-methoxyphenyl]methyl-triphenylphosphanium;bromide
• CAS: 1415228-96-4
• 化学式: Br*C₅₀H₄₆O₆P
• 分子量: 853.789
• InChiKey: AMAWWZPMHBHURB-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  7.28
• 重原子数：
  58
• 可旋转键数：
  16
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  63.2
• 氢给体数：
  0
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  [4-[2-[2-[4-(5-Formyl-2-methoxyphenoxy)-2-methoxyphenyl]ethyl]-4-methoxyphenyl]-3-methoxyphenyl]methyl-triphenylphosphanium;bromide 在 palladium 10% on activated carbon 、 氢气 、 sodium methylate 、 三溴化硼 作用下， 以 二氯甲烷 、 乙酸乙酯 为溶剂， 反应 33.0h， 生成 14-Oxapentacyclo[20.2.2.210,13.115,19.02,7]nonacosa-1(24),2(7),3,5,10,12,15,17,19(27),22,25,28-dodecaene-5,11,16,24-tetrol
  参考文献：
  名称：

  Riccardin C derivatives as anti-MRSA agents: Structure–activity relationship of a series of hydroxylated bis(bibenzyl)s

  摘要：

  Members of a series of macrocyclic bis(bibenzyl) riccardin-class derivatives were found to exhibit antibacterial activity towards methicillin-resistant Staphylococcus aureus (anti-MRSA activity). Structure-activity relationship (SAR) studies were conducted, focusing on the number and position of the hydroxyl groups. The minimum essential structure for anti-MRSA activity was also investigated. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2012.10.052
• 作为产物：
  描述：

  4-羟基-2-甲氧基苯甲醛 在 lithium aluminium tetrahydride 、 18-冠醚-6 、 四溴化碳 、 palladium 10% on activated carbon 、 氢气 、 potassium carbonate 、 三乙胺 、 三苯基膦 作用下， 以 乙醚 、 二氯甲烷 、 水 、 乙酸乙酯 、 N,N-二甲基甲酰胺 、 乙腈 、 苯 为溶剂， 反应 86.0h， 生成 [4-[2-[2-[4-(5-Formyl-2-methoxyphenoxy)-2-methoxyphenyl]ethyl]-4-methoxyphenyl]-3-methoxyphenyl]methyl-triphenylphosphanium;bromide
  参考文献：
  名称：

  Riccardin C derivatives as anti-MRSA agents: Structure–activity relationship of a series of hydroxylated bis(bibenzyl)s

  摘要：

  Members of a series of macrocyclic bis(bibenzyl) riccardin-class derivatives were found to exhibit antibacterial activity towards methicillin-resistant Staphylococcus aureus (anti-MRSA activity). Structure-activity relationship (SAR) studies were conducted, focusing on the number and position of the hydroxyl groups. The minimum essential structure for anti-MRSA activity was also investigated. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2012.10.052

文献信息

• Riccardin C derivatives as anti-MRSA agents: Structure–activity relationship of a series of hydroxylated bis(bibenzyl)s
  作者：Hiromi Sawada、Miki Okazaki、Daichi Morita、Teruo Kuroda、Kenji Matsuno、Yuichi Hashimoto、Hiroyuki Miyachi

  DOI：10.1016/j.bmcl.2012.10.052

  日期：2012.12

  Members of a series of macrocyclic bis(bibenzyl) riccardin-class derivatives were found to exhibit antibacterial activity towards methicillin-resistant Staphylococcus aureus (anti-MRSA activity). Structure-activity relationship (SAR) studies were conducted, focusing on the number and position of the hydroxyl groups. The minimum essential structure for anti-MRSA activity was also investigated. (C) 2012 Elsevier Ltd. All rights reserved.