5-[(4-(1-pyrenoylamino)butyl)carbamoyl]-1H-pyrrole-2-carbonylguanidinium trifluoroacetate | 1036202-43-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 芘
• 英文名称: 5-[(4-(1-pyrenoylamino)butyl)carbamoyl]-1H-pyrrole-2-carbonylguanidinium trifluoroacetate
• 英文别名: 2-N-carbamimidoyl-5-N-[4-(pyrene-1-carbonylamino)butyl]-1H-pyrrole-2,5-dicarboxamide;2,2,2-trifluoroacetic acid
• CAS: 1036202-43-3
• 化学式: C₂HF₃O₂*C₂₈H₂₆N₆O₃
• 分子量: 608.577
• InChiKey: XNPDBSCIUVYPHF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.11
• 重原子数：
  44
• 可旋转键数：
  8
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  197
• 氢给体数：
  6
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  、 三氟乙酸 以 二氯甲烷 为溶剂， 反应 1.0h， 以100%的产率得到5-[(4-(1-pyrenoylamino)butyl)carbamoyl]-1H-pyrrole-2-carbonylguanidinium trifluoroacetate
  参考文献：
  名称：

  A novel pyrene-guanidiniocarbonyl-pyrrole cation efficiently differentiates between ds-DNA and ds-RNA by two independent, sensitive spectroscopic methods

  摘要：

  At micromolar concentrations and equimolar conditions in respect to basepairs, a novel pyrene-guanidiniocarbonyl-pyrrole cation 1 exhibited a strong ICD signal at about lambda = 300 nm specifically upon the interaction with ds-DNA, while under the same conditions a new fluorescence maximum at lambda = 480 nm appeared exclusively upon the addition of ds-RNA. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.03.060

文献信息

• A novel pyrene-guanidiniocarbonyl-pyrrole cation efficiently differentiates between ds-DNA and ds-RNA by two independent, sensitive spectroscopic methods
  作者：Laura Hernandez-Folgado、Carsten Schmuck、Sanja Tomić、Ivo Piantanida

  DOI：10.1016/j.bmcl.2008.03.060

  日期：2008.5

  At micromolar concentrations and equimolar conditions in respect to basepairs, a novel pyrene-guanidiniocarbonyl-pyrrole cation 1 exhibited a strong ICD signal at about lambda = 300 nm specifically upon the interaction with ds-DNA, while under the same conditions a new fluorescence maximum at lambda = 480 nm appeared exclusively upon the addition of ds-RNA. (C) 2008 Elsevier Ltd. All rights reserved.