6-hydroxyhexanoic acid 2-[2-(4-pyren-1-ylbutyrylamino)ethoxy]ethyl ester | 1232169-24-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 芘
• 英文名称: 6-hydroxyhexanoic acid 2-[2-(4-pyren-1-ylbutyrylamino)ethoxy]ethyl ester
• 英文别名: 2-[2-(4-Pyren-1-ylbutanoylamino)ethoxy]ethyl 6-hydroxyhexanoate；2-[2-(4-pyren-1-ylbutanoylamino)ethoxy]ethyl 6-hydroxyhexanoate
• CAS: 1232169-24-2
• 化学式: C₃₀H₃₅NO₅
• 分子量: 489.612
• InChiKey: YMQSXFSBQPNAHH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  36
• 可旋转键数：
  16
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  84.9
• 氢给体数：
  2
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  6-hydroxyhexanoic acid 2-[2-(4-pyren-1-ylbutyrylamino)ethoxy]ethyl ester 在 lipoprotein lipase from Pseudomonas sp. 作用下， 反应 16.0h， 生成 N-[2-(2-hydroxyethoxy)ethyl]-4-pyren-1-ylbutyramide
  参考文献：
  名称：

  Screening of polymeric supports and enzymes for the development of an endo enzyme cleavable linker

  摘要：

  Several polymeric supports possessing an ester moiety were prepared and a range of enzymes was investigated to hydrolyse the ester linkage and release a signalling group into solution for applications in immunoassays. Pseudomonas lipases were found to most readily cleave the solution-phase analogue and this observation translated well to the corresponding polymeric supports, where the most effective were PEGA resins and the LPOS support PEG-6000. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2010.03.040
• 作为产物：
  描述：

  6-hydroxyhexanoic acid 2-(2-aminoethoxy)ethyl ester 、 N-羟基琥珀酰亚胺酯1-芘丁酸 在 4-二甲氨基吡啶 作用下， 以 二氯甲烷 为溶剂， 反应 72.0h， 以23%的产率得到6-hydroxyhexanoic acid 2-[2-(4-pyren-1-ylbutyrylamino)ethoxy]ethyl ester
  参考文献：
  名称：

  Screening of polymeric supports and enzymes for the development of an endo enzyme cleavable linker

  摘要：

  Several polymeric supports possessing an ester moiety were prepared and a range of enzymes was investigated to hydrolyse the ester linkage and release a signalling group into solution for applications in immunoassays. Pseudomonas lipases were found to most readily cleave the solution-phase analogue and this observation translated well to the corresponding polymeric supports, where the most effective were PEGA resins and the LPOS support PEG-6000. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2010.03.040

文献信息

• Screening of polymeric supports and enzymes for the development of an endo enzyme cleavable linker
  作者：Ana Chiva、David E. Williams、Alethea B. Tabor、Helen C. Hailes

  DOI：10.1016/j.tetlet.2010.03.040

  日期：2010.5

  Several polymeric supports possessing an ester moiety were prepared and a range of enzymes was investigated to hydrolyse the ester linkage and release a signalling group into solution for applications in immunoassays. Pseudomonas lipases were found to most readily cleave the solution-phase analogue and this observation translated well to the corresponding polymeric supports, where the most effective were PEGA resins and the LPOS support PEG-6000. (C) 2010 Elsevier Ltd. All rights reserved.