(4S)-2-[6-[3-(methoxycarbonyldisulfanyl)propoxycarbonyloxy]-1,3-benzothiazol-2-yl]-4,5-dihydro-1,3-thiazole-4-carboxylic acid | 1176834-45-9

• 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: (4S)-2-[6-[3-(methoxycarbonyldisulfanyl)propoxycarbonyloxy]-1,3-benzothiazol-2-yl]-4,5-dihydro-1,3-thiazole-4-carboxylic acid
• CAS: 1176834-45-9
• 化学式: C₁₇H₁₆N₂O₇S₄
• 分子量: 488.587
• InChiKey: NANQBPLPKSVBNP-LLVKDONJSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4
• 重原子数：
  30
• 可旋转键数：
  12
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.35
• 拓扑面积：
  229
• 氢给体数：
  1
• 氢受体数：
  13

反应信息

• 作为产物：
  描述：

  3-[(methoxycarbonyl)disulfanyl]-1-propanyl chloroformate 、 D-luciferin potassium salt 在 sodium hydroxide 作用下， 以 水 为溶剂， 反应 4.0h， 生成 (4S)-2-[6-[3-(methoxycarbonyldisulfanyl)propoxycarbonyloxy]-1,3-benzothiazol-2-yl]-4,5-dihydro-1,3-thiazole-4-carboxylic acid
  参考文献：
  名称：

  An improved synthesis of releasable luciferin–CPP conjugates

  摘要：

  We have improved the synthesis of a previously published luciferin-linker, used in an assay enabling rapid real-time quantification of luciferin-CPP conjugate uptake and cytosolic cargo release. We also present the synthesis of a new luciferin-linker with the same conjugation ability. Both luciferin-linkers are now available via an efficient one-pot procedure. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2009.06.038

文献信息

• An improved synthesis of releasable luciferin–CPP conjugates
  作者：Emelía Eiríksdóttir、Ülo Langel、Katri Rosenthal-Aizman

  DOI：10.1016/j.tetlet.2009.06.038

  日期：2009.8

  We have improved the synthesis of a previously published luciferin-linker, used in an assay enabling rapid real-time quantification of luciferin-CPP conjugate uptake and cytosolic cargo release. We also present the synthesis of a new luciferin-linker with the same conjugation ability. Both luciferin-linkers are now available via an efficient one-pot procedure. (C) 2009 Elsevier Ltd. All rights reserved.