benzyl N,N-bis[2-(1,3-dioxoisoindol-2-yl)ethyl]carbamate | 1040797-37-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 异吲哚及其衍生物
• 英文名称: benzyl N,N-bis[2-(1,3-dioxoisoindol-2-yl)ethyl]carbamate
• CAS: 1040797-37-2
• 化学式: C₂₈H₂₃N₃O₆
• 分子量: 497.507
• InChiKey: PAYKINHZRBOLLR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  37
• 可旋转键数：
  9
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  104
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  benzyl N,N-bis[2-(1,3-dioxoisoindol-2-yl)ethyl]carbamate 在 肼 作用下， 以 乙腈 为溶剂， 反应 24.0h， 生成 Benzyl bis(2-aminoethyl)carbamate
  参考文献：
  名称：

  Cu²⁺-Responsive Bimodal (Optical/MRI) Contrast Agent for Cellular Imaging

  摘要：

  A water-soluble T-1 magnetic resonance imaging contrast agent (1) has been synthesized. The bimodal contrast agent 1 responds to the Cu2+ ion in living cells by enhancing the MRI modality signal whereas the optical signal gradually drops. This dual modality probe response depends on the cellular free copper ions in RAW 264.7 cells even at the micromolar level.

  DOI：

  10.1021/ol4025293
• 作为产物：
  描述：

  bis(phthalimidylethyl)amine 、 氯甲酸苄酯 在 4-二甲氨基吡啶 、 N,N-二异丙基乙胺 作用下， 以 二氯甲烷 为溶剂， 反应 18.0h， 生成 benzyl N,N-bis[2-(1,3-dioxoisoindol-2-yl)ethyl]carbamate
  参考文献：
  名称：

  Cu²⁺-Responsive Bimodal (Optical/MRI) Contrast Agent for Cellular Imaging

  摘要：

  A water-soluble T-1 magnetic resonance imaging contrast agent (1) has been synthesized. The bimodal contrast agent 1 responds to the Cu2+ ion in living cells by enhancing the MRI modality signal whereas the optical signal gradually drops. This dual modality probe response depends on the cellular free copper ions in RAW 264.7 cells even at the micromolar level.

  DOI：

  10.1021/ol4025293

文献信息

• Cu²⁺-Responsive Bimodal (Optical/MRI) Contrast Agent for Cellular Imaging
  作者：Joo Hee Jang、Sankarprasad Bhuniya、Jongeun Kang、Areum Yeom、Kwan Soo Hong、Jong Seung Kim

  DOI：10.1021/ol4025293

  日期：2013.9.20

  A water-soluble T-1 magnetic resonance imaging contrast agent (1) has been synthesized. The bimodal contrast agent 1 responds to the Cu2+ ion in living cells by enhancing the MRI modality signal whereas the optical signal gradually drops. This dual modality probe response depends on the cellular free copper ions in RAW 264.7 cells even at the micromolar level.