2'-(2-tert-butoxy-1-tert-butoxycarbonylaminoethyl)-5'-methyl[2,4']bis-oxazolyl-4-carboxyamide | 1064765-59-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 2'-(2-tert-butoxy-1-tert-butoxycarbonylaminoethyl)-5'-methyl[2,4']bis-oxazolyl-4-carboxyamide
• CAS: 1064765-59-8
• 化学式: C₁₉H₂₈N₄O₆
• 分子量: 408.455
• InChiKey: YMSPIPCDGNQJFS-LBPRGKRZSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.12
• 重原子数：
  29.0
• 可旋转键数：
  6.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.58
• 拓扑面积：
  142.71
• 氢给体数：
  2.0
• 氢受体数：
  8.0

反应信息

• 作为反应物：
  描述：

  2'-(2-tert-butoxy-1-tert-butoxycarbonylaminoethyl)-5'-methyl[2,4']bis-oxazolyl-4-carboxyamide 在 劳森试剂 作用下， 以 四氢呋喃 为溶剂， 反应 8.0h， 生成
  参考文献：
  名称：

  Synthesis and Antitumor Activity of Mechercharmycin A Analogues

  摘要：

  Several analogues of the cytotoxic thiopeptide IB-01211 or mechercharmycin A (1) have been synthesized. The cytotoxicity of 1 and the synthesized analogues were evaluated against a panel of three human tumor cell lines. Thiopeptide 1 and the most active derivatives 2 and 3c were chosen for further studies on effects on cell cycle progression and induction of apoptosis. Interestingly, the inhibition of cell division and activation of a programmed cell death by apoptosis were detected.

  DOI：

  10.1021/jm800513w
• 作为产物：
  描述：

  methyl 2'-[2-(tert-butoxy-1-tert-butoxycarbonylamino-ethyl)]-5'-methyl-[2,4']bisoxazolyl-4-carboxylate 在 ammonium hydroxide 作用下， 以 甲醇 、 水 为溶剂， 反应 17.0h， 以83%的产率得到2'-(2-tert-butoxy-1-tert-butoxycarbonylaminoethyl)-5'-methyl[2,4']bis-oxazolyl-4-carboxyamide
  参考文献：
  名称：

  Synthesis and Antitumor Activity of Mechercharmycin A Analogues

  摘要：

  Several analogues of the cytotoxic thiopeptide IB-01211 or mechercharmycin A (1) have been synthesized. The cytotoxicity of 1 and the synthesized analogues were evaluated against a panel of three human tumor cell lines. Thiopeptide 1 and the most active derivatives 2 and 3c were chosen for further studies on effects on cell cycle progression and induction of apoptosis. Interestingly, the inhibition of cell division and activation of a programmed cell death by apoptosis were detected.

  DOI：

  10.1021/jm800513w