[(2-tertbutoxycarbonylamino-ethyl)-{2-[(10H-indolo[3,2-b]quinoline-11-carbonyl)-amino]-acetyl}-amino]-acetic acid | 1029684-12-5

• 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: [(2-tertbutoxycarbonylamino-ethyl)-{2-[(10H-indolo[3,2-b]quinoline-11-carbonyl)-amino]-acetyl}-amino]-acetic acid
• CAS: 1029684-12-5
• 化学式: C₂₇H₂₉N₅O₆
• 分子量: 519.557
• InChiKey: DHENOZAANPEBDX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.04
• 重原子数：
  38.0
• 可旋转键数：
  8.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  153.72
• 氢给体数：
  4.0
• 氢受体数：
  6.0

反应信息

• 作为反应物：
  描述：

  [(2-tertbutoxycarbonylamino-ethyl)-{2-[(10H-indolo[3,2-b]quinoline-11-carbonyl)-amino]-acetyl}-amino]-acetic acid 、 乙酸酐 、 alkaline earth salt of/the/ methylsulfuric acid 生成 N-[2-[2-acetamidoethyl-[2-[2-[[2-(6-hydroxyhexylamino)-2-oxoethyl]-[2-(10H-indolo[3,2-b]quinoline-11-carbonylamino)acetyl]amino]ethylamino]-2-oxoethyl]amino]-2-oxoethyl]-10H-indolo[3,2-b]quinoline-11-carboxamide
  参考文献：
  名称：

  Design, synthesis and antiproliferative properties of oligomers with chromophore units linked by amide backbones

  摘要：

  The preparation of oligomers made up of several chromophore units as compounds with potential fluorescent and antiproliferative properties is described. Specifically, chromophore units with protected-amino groups and one carboxylic group are described, together with methods to assemble these units using peptide chemistry. Some of these compounds have antiproliferative activity. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.02.045
• 作为产物：
  描述：

  [(2-tert-butoxycarbonylamino-ethyl)-{2-[10H-indolo[3,2-b]quinoline-11-carbonylamino]-acetyl}-amino]acetic acid methyl ester 在 sodium hydroxide 作用下， 以 乙醇 为溶剂， 反应 2.0h， 以20%的产率得到[(2-tertbutoxycarbonylamino-ethyl)-{2-[(10H-indolo[3,2-b]quinoline-11-carbonyl)-amino]-acetyl}-amino]-acetic acid
  参考文献：
  名称：

  Design, synthesis and antiproliferative properties of oligomers with chromophore units linked by amide backbones

  摘要：

  The preparation of oligomers made up of several chromophore units as compounds with potential fluorescent and antiproliferative properties is described. Specifically, chromophore units with protected-amino groups and one carboxylic group are described, together with methods to assemble these units using peptide chemistry. Some of these compounds have antiproliferative activity. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.02.045