4-(3-tert-Butoxycarbonylamino-propoxy)-3-(3-isopropenyl-quinolin-4-yl)-benzoic acid | 491602-13-2

• 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: 4-(3-tert-Butoxycarbonylamino-propoxy)-3-(3-isopropenyl-quinolin-4-yl)-benzoic acid
• 英文别名: 4-[3-[(2-Methylpropan-2-yl)oxycarbonylamino]propoxy]-3-(3-prop-1-en-2-ylquinolin-4-yl)benzoic acid；4-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propoxy]-3-(3-prop-1-en-2-ylquinolin-4-yl)benzoic acid
• CAS: 491602-13-2
• 化学式: C₂₇H₃₀N₂O₅
• 分子量: 462.546
• InChiKey: IMCADTQQSPWUFY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.8
• 重原子数：
  34
• 可旋转键数：
  10
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  97.8
• 氢给体数：
  2
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  N,N'-bis( tert-butoxycarbonyl)-1H-pyrazole-1-carboxamidine 、 Fmoc-Orn(Dde)-OH 、 (2S,3R)-2-(1-Carboxy-2-methyl-propenylcarbamoyl)-3-hydroxy-3-methyl-pyrrolidine-1-carboxylic acid 9H-fluoren-9-ylmethyl ester 、 4-(3-tert-Butoxycarbonylamino-propoxy)-3-(3-isopropenyl-quinolin-4-yl)-benzoic acid 以82%的产率得到
  参考文献：
  名称：

  Design and Synthesis of a Solid-Supported FR225659 Derivative for Its Receptor Screening

  摘要：

  We describe the design and synthesis of latex particles attached to an FR225659 derivative to identify its receptor proteins. Two key building blocks were prepared by two-step degradation of FR225659 under basic conditions. The designed ligand showed an acceptable level of biological activity to make it of potential value for use in affinity-supported receptor identification. Affinity purification of FR225659-binding proteins using the latex nanoparticles provided three candidate receptor peptides for the biological activity.

  DOI：

  10.1021/ol049100q
• 作为产物：
  描述：

  4-Hydroxy-3-(3-isopropenyl-quinolin-4-yl)-benzoic acid 在 sodium hydroxide 、 potassium carbonate 作用下， 以 甲醇 、 N,N-二甲基甲酰胺 为溶剂， 反应 42.0h， 生成 4-(3-tert-Butoxycarbonylamino-propoxy)-3-(3-isopropenyl-quinolin-4-yl)-benzoic acid
  参考文献：
  名称：

  Design and Synthesis of a Solid-Supported FR225659 Derivative for Its Receptor Screening

  摘要：

  We describe the design and synthesis of latex particles attached to an FR225659 derivative to identify its receptor proteins. Two key building blocks were prepared by two-step degradation of FR225659 under basic conditions. The designed ligand showed an acceptable level of biological activity to make it of potential value for use in affinity-supported receptor identification. Affinity purification of FR225659-binding proteins using the latex nanoparticles provided three candidate receptor peptides for the biological activity.

  DOI：

  10.1021/ol049100q

文献信息

• Design and Synthesis of a Solid-Supported FR225659 Derivative for Its Receptor Screening
  作者：Tatsuya Zenkoh、Hidetaka Hatori、Hiroshi Tanaka、Makoto Hasegawa、Mamoru Hatakeyama、Yasuaki Kabe、Hiroyuki Setoi、Haruma Kawaguchi、Hiroshi Handa、Takashi Takahashi

  DOI：10.1021/ol049100q

  日期：2004.7.1

  We describe the design and synthesis of latex particles attached to an FR225659 derivative to identify its receptor proteins. Two key building blocks were prepared by two-step degradation of FR225659 under basic conditions. The designed ligand showed an acceptable level of biological activity to make it of potential value for use in affinity-supported receptor identification. Affinity purification of FR225659-binding proteins using the latex nanoparticles provided three candidate receptor peptides for the biological activity.