2-[2,6-Bis(N-tert-butoxycarbonyl-L-phenylalanylamino)-4-pyridyloxy] acetic acid | 350697-57-3

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: 2-[2,6-Bis(N-tert-butoxycarbonyl-L-phenylalanylamino)-4-pyridyloxy] acetic acid
• 英文别名: 2-[2,6-bis[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]amino]pyridin-4-yl]oxyacetic acid
• CAS: 350697-57-3
• 化学式: C₃₅H₄₃N₅O₉
• 分子量: 677.755
• InChiKey: VMDZTUGOVIISSR-UIOOFZCWSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  49
• 可旋转键数：
  17
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.37
• 拓扑面积：
  194
• 氢给体数：
  5
• 氢受体数：
  10

反应信息

• 作为反应物：
  描述：

  BOC-L-脯氨酸 、 N-Boc-L-缬氨酸 、 N-叔丁氧羰基-L-丙氨酸 、 2-[2,6-Bis(N-tert-butoxycarbonyl-L-phenylalanylamino)-4-pyridyloxy] acetic acid 、 alkaline earth salt of/the/ methylsulfuric acid 以17%的产率得到
  参考文献：
  名称：

  Identification of Sequence Selective Receptors for Peptides with a Carboxylic Acid Terminus

  摘要：

  Split-and-mix libraries of resin-bound "tweezer" receptors have been prepared and screened to identify receptors for dye-labelled tripeptides. The receptors incorporate a diamidopyridine unit to serve as a specific recognition site for the CO2H group, leading to strong and selective receptors for peptide guests with a CO2H terminus. The role of the dye-label, attached to the peptide guest to allow visualisation of selective recognition events in the screening experiments, has also been examined and was found to have a significant influence on the binding selectivities.

  DOI：

  10.1002/1521-3765(20010504)7:9<1889::aid-chem1889>3.0.co;2-7
• 作为产物：
  描述：

  4-(benzyloxy)pyridine-2,6-diamine 在 10percent Pd/C N,O-双三甲硅基乙酰胺 、 ammonium formate 、 potassium carbonate 作用下， 以 甲醇 、 N,N-二甲基甲酰胺 、 乙腈 为溶剂， 反应 30.5h， 生成 2-[2,6-Bis(N-tert-butoxycarbonyl-L-phenylalanylamino)-4-pyridyloxy] acetic acid
  参考文献：
  名称：

  Identification of Sequence Selective Receptors for Peptides with a Carboxylic Acid Terminus

  摘要：

  Split-and-mix libraries of resin-bound "tweezer" receptors have been prepared and screened to identify receptors for dye-labelled tripeptides. The receptors incorporate a diamidopyridine unit to serve as a specific recognition site for the CO2H group, leading to strong and selective receptors for peptide guests with a CO2H terminus. The role of the dye-label, attached to the peptide guest to allow visualisation of selective recognition events in the screening experiments, has also been examined and was found to have a significant influence on the binding selectivities.

  DOI：

  10.1002/1521-3765(20010504)7:9<1889::aid-chem1889>3.0.co;2-7

文献信息

• Identification of Sequence Selective Receptors for Peptides with a Carboxylic Acid Terminus
  作者：Tobias Braxmeier、Mariangela Demarcus、Thilo Fessmann、Stephen McAteer、Jeremy D. Kilburn

  DOI：10.1002/1521-3765(20010504)7:9<1889::aid-chem1889>3.0.co;2-7

  日期：2001.5.4

  Split-and-mix libraries of resin-bound "tweezer" receptors have been prepared and screened to identify receptors for dye-labelled tripeptides. The receptors incorporate a diamidopyridine unit to serve as a specific recognition site for the CO2H group, leading to strong and selective receptors for peptide guests with a CO2H terminus. The role of the dye-label, attached to the peptide guest to allow visualisation of selective recognition events in the screening experiments, has also been examined and was found to have a significant influence on the binding selectivities.