tert-butyl (Z)-(2-(4-(3,5-difluoro-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-imidazol-1-yl)ethyl)carbamate | 1609105-69-2

• 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: tert-butyl (Z)-(2-(4-(3,5-difluoro-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-imidazol-1-yl)ethyl)carbamate
• CAS: 1609105-69-2
• 化学式: C₁₈H₂₁F₂N₃O₄
• 分子量: 381.379
• InChiKey: AIDNURVDEFYPMW-ZROIWOOFSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  27.0
• 可旋转键数：
  4.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.39
• 拓扑面积：
  91.23
• 氢给体数：
  2.0
• 氢受体数：
  5.0

反应信息

• 作为反应物：
  描述：

  tert-butyl (Z)-(2-(4-(3,5-difluoro-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-imidazol-1-yl)ethyl)carbamate 在 三氟乙酸 作用下， 以 二氯甲烷 为溶剂， 生成 (Z)-1-(2-aminoethyl)-4-(3,5-difluoro-4-hydroxybenzylidene)-2-methyl-1Himidazol-5(4H)-one
  参考文献：
  名称：

  [EN] BIFACIAL PEPTIDE NUCLEIC ACID PROBES AND METHODS OF USING THEREOF
  [FR] SONDES D'ACIDES NUCLÉIQUES PEPTIDIQUES BIFACIALES ET LEURS PROCÉDÉS D'UTILISATION

  摘要：

  Disclosed herein are bifacial peptide nucleic acid probes. These probes can include a triplex hybrid forming moiety (e.g., a plurality of binding motifs disposed along a peptidyl backbone) conjugated to a prosthetic group. The triplex hybrid forming moiety can bind to a non-canonical base pairing site in a target nucleic acid via triplex hybridization. In this way, a variety of prosthetic groups (e.g., dyes, labels, reactive groups, etc.) can be selectively delivered to a target nucleic acid (e.g.,in vivo,in vitro, orex vivo).

  公开号：

  WO2024010977A1
• 作为产物：
  描述：

  3,5-二氟-4-羟基苯甲醛 在 sodium acetate 、 potassium carbonate 作用下， 以 乙醇 为溶剂， 反应 5.0h， 生成 tert-butyl (Z)-(2-(4-(3,5-difluoro-4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-imidazol-1-yl)ethyl)carbamate
  参考文献：
  名称：

  Plug-and-Play Fluorophores Extend the Spectral Properties of Spinach

  摘要：

  Spinach and Spinach2 are RNA aptamers that can be used for the genetic encoding of fluorescent RNA. Spinach2 binds and activates the fluorescence of (Z)-4-(3,5-difluoro-4-hydroxybenzylidene)-1,2-dimethyl-1H-imidazol-5 (4H)-one (DFHBI), allowing the dynamic localizations of Spinach2-tagged RNAs to be imaged in live cells. The spectral properties of Spinach2 are limited by DFHBI, which produces fluorescence that is bluish-green and is not optimized for filters commonly used in fluorescence microscopes. Here we characterize the structural features that are required for fluorophore binding to Spinach2 and describe novel fluorophores that bind and are switched to a fluorescent state by Spinach2. These diverse Spinach2 fluorophore complexes exhibit fluorescence that is more compatible with existing microscopy filter sets and allows Spinach2-tagged constructs to be imaged with either GFP or YFP filter cubes. Thus, these "plug-and-play" fluorophores allow the spectral properties of Spinach2 to be altered on the basis of the specific spectral needs of the experiment.

  DOI：

  10.1021/ja410819x