methyl (2S)-2-[[2-[[8-[[2-[[(1S)-2-methoxy-2-oxo-1-phenylethyl]amino]acetyl]amino]-9,10-dioxoanthracen-1-yl]amino]-2-oxoethyl]amino]-2-phenylacetate | 1228598-40-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 蒽
• 英文名称: methyl (2S)-2-[[2-[[8-[[2-[[(1S)-2-methoxy-2-oxo-1-phenylethyl]amino]acetyl]amino]-9,10-dioxoanthracen-1-yl]amino]-2-oxoethyl]amino]-2-phenylacetate
• CAS: 1228598-40-0
• 化学式: C₃₆H₃₂N₄O₈
• 分子量: 648.672
• InChiKey: AGYLTYDUKPQYSG-ACHIHNKUSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.2
• 重原子数：
  48
• 可旋转键数：
  14
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  169
• 氢给体数：
  4
• 氢受体数：
  10

反应信息

• 作为产物：
  描述：

  1,8-二氨基蒽醌 在 吡啶 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 24.0h， 生成 methyl (2S)-2-[[2-[[8-[[2-[[(1S)-2-methoxy-2-oxo-1-phenylethyl]amino]acetyl]amino]-9,10-dioxoanthracen-1-yl]amino]-2-oxoethyl]amino]-2-phenylacetate
  参考文献：
  名称：

  Design, synthesis and evaluation of telomerase inhibitory, hTERT repressing, and anti-proliferation activities of symmetrical 1,8-disubstituted amidoanthraquinones

  摘要：

  A series of symmetrical disubstituded 1,8-diamidoanthraquinones were synthesized and evaluated for anti-proliferation, telomerase inhibitory by TRAP assay, and hTERT expression by SEAP assay. All of the compounds tested, except for compounds 3a and 3s were selected by the NCI screening system. In addition, compounds 4e and 4k exhibited inhibitory effects on telomerase activity. Taken together, our findings indicated that the analysis of cytotoxicity and telomerase inhibition might provide information applicable for further developing potential telomerase targeting strategy. Crown Copyright (C) 2012 Published by Elsevier Masson SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2012.01.044

文献信息

• Design, synthesis and evaluation of telomerase inhibitory, hTERT repressing, and anti-proliferation activities of symmetrical 1,8-disubstituted amidoanthraquinones
  作者：Chia-Chung Lee、Kuo-Feng Huang、Deh-Ming Chang、Jung-Jung Hsu、Fong-Chun Huang、Kai-Ning Shih、Chun-Liang Chen、Tsung-Chih Chen、Ruei-Huei Chen、Jing-Jer Lin、Hsu-Shan Huang

  DOI：10.1016/j.ejmech.2012.01.044

  日期：2012.4

  A series of symmetrical disubstituded 1,8-diamidoanthraquinones were synthesized and evaluated for anti-proliferation, telomerase inhibitory by TRAP assay, and hTERT expression by SEAP assay. All of the compounds tested, except for compounds 3a and 3s were selected by the NCI screening system. In addition, compounds 4e and 4k exhibited inhibitory effects on telomerase activity. Taken together, our findings indicated that the analysis of cytotoxicity and telomerase inhibition might provide information applicable for further developing potential telomerase targeting strategy. Crown Copyright (C) 2012 Published by Elsevier Masson SAS. All rights reserved.