8-chloro-7-[[[8-chloro-7-[[[8-chloro-7-[[[8-chloro-7-[[[8-chloro-7-[[hydroxy-[(2-methylpropan-2-yl)oxy]methylidene]amino]-4-(2-methylpropoxy)quinolin-2-yl]-hydroxymethylidene]amino]-4-(2-methylpropoxy)quinolin-2-yl]-hydroxymethylidene]amino]-4-(2-methylpropoxy)quinolin-2-yl]-hydroxymethylidene]amino]-4-(2-methylpropoxy)quinolin-2-yl]-hydroxymethylidene]amino]-N-[8-chloro-2-[N-[8-chloro-2-[N-[8-chloro-2-methoxycarbonyl-4-(2-methylpropoxy)quinolin-7-yl]-C-hydroxycarbonimidoyl]-4-(2-methylpropoxy)quinolin-7-yl]-C-hydroxycarbonimidoyl]-4-(2-methylpropoxy)quinolin-7-yl]-4-(2-methylpropoxy)quinoline-2-carboximidic acid | 1206720-42-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: 8-chloro-7-[[[8-chloro-7-[[[8-chloro-7-[[[8-chloro-7-[[[8-chloro-7-[[hydroxy-[(2-methylpropan-2-yl)oxy]methylidene]amino]-4-(2-methylpropoxy)quinolin-2-yl]-hydroxymethylidene]amino]-4-(2-methylpropoxy)quinolin-2-yl]-hydroxymethylidene]amino]-4-(2-methylpropoxy)quinolin-2-yl]-hydroxymethylidene]amino]-4-(2-methylpropoxy)quinolin-2-yl]-hydroxymethylidene]amino]-N-[8-chloro-2-[N-[8-chloro-2-[N-[8-chloro-2-methoxycarbonyl-4-(2-methylpropoxy)quinolin-7-yl]-C-hydroxycarbonimidoyl]-4-(2-methylpropoxy)quinolin-7-yl]-C-hydroxycarbonimidoyl]-4-(2-methylpropoxy)quinolin-7-yl]-4-(2-methylpropoxy)quinoline-2-carboximidic acid
• CAS: 1206720-42-4
• 化学式: C₁₁₈H₁₁₆Cl₈N₁₆O₁₉
• 分子量: 2345.94
• InChiKey: AIBLPPOHWRWOGN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  32.7
• 重原子数：
  161
• 可旋转键数：
  43
• 环数：
  16.0
• sp3杂化的碳原子比例：
  0.31
• 拓扑面积：
  473
• 氢给体数：
  8
• 氢受体数：
  35

反应信息

• 作为产物：
  描述：

  、 在 N,N-二异丙基乙胺 作用下， 以 二氯甲烷 为溶剂， 生成 8-chloro-7-[[[8-chloro-7-[[[8-chloro-7-[[[8-chloro-7-[[[8-chloro-7-[[hydroxy-[(2-methylpropan-2-yl)oxy]methylidene]amino]-4-(2-methylpropoxy)quinolin-2-yl]-hydroxymethylidene]amino]-4-(2-methylpropoxy)quinolin-2-yl]-hydroxymethylidene]amino]-4-(2-methylpropoxy)quinolin-2-yl]-hydroxymethylidene]amino]-4-(2-methylpropoxy)quinolin-2-yl]-hydroxymethylidene]amino]-N-[8-chloro-2-[N-[8-chloro-2-[N-[8-chloro-2-methoxycarbonyl-4-(2-methylpropoxy)quinolin-7-yl]-C-hydroxycarbonimidoyl]-4-(2-methylpropoxy)quinolin-7-yl]-C-hydroxycarbonimidoyl]-4-(2-methylpropoxy)quinolin-7-yl]-4-(2-methylpropoxy)quinoline-2-carboximidic acid
  参考文献：
  名称：

  通过氯和氟取代的喹啉寡酰胺的交叉杂交形成异源双螺旋。

  摘要：

  已经合成了8-氯喹啉的低聚酰胺，并显示在溶液和固态下均组装成双螺旋二聚体，并与8-氟喹啉的低酰胺类似物进行交叉杂交。这些双螺旋的旋性可以通过手性残基来控制。

  DOI：

  10.1039/b910435f