ethyl 2-(6-(6-methoxy-5-(4-fluorophenylsulfonamido)pyridin-3-yl)-[1,2,4] triazolo[1,5-a]pyridin-2-ylamino)acetate | 1456778-83-8

• 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: ethyl 2-(6-(6-methoxy-5-(4-fluorophenylsulfonamido)pyridin-3-yl)-[1,2,4] triazolo[1,5-a]pyridin-2-ylamino)acetate
• 英文别名: Ethyl 2-[[6-[5-[(4-fluorophenyl)sulfonylamino]-6-methoxypyridin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]acetate；ethyl 2-[[6-[5-[(4-fluorophenyl)sulfonylamino]-6-methoxypyridin-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]acetate
• CAS: 1456778-83-8
• 化学式: C₂₂H₂₁FN₆O₅S
• 分子量: 500.51
• InChiKey: WNQIPKTTWSVBJF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  35
• 可旋转键数：
  10
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  145
• 氢给体数：
  2
• 氢受体数：
  11

反应信息

• 作为反应物：
  描述：

  ethyl 2-(6-(6-methoxy-5-(4-fluorophenylsulfonamido)pyridin-3-yl)-[1,2,4] triazolo[1,5-a]pyridin-2-ylamino)acetate 在 氨 作用下， 以 甲醇 为溶剂， 反应 48.0h， 以78.5%的产率得到2-(6-(5-(4-fluorophenylsulfonamido)-6-methoxypyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-ylamino)acetamide
  参考文献：
  名称：

  Synthesis and anticancer activity evaluation of a series of [1,2,4]triazolo[1,5-a]pyridinylpyridines in vitro and in vivo

  摘要：

  A series of [1,2,4]triazolo[1,5-a]pyridinylpyridines were synthesized and characterized. Their antiproliferative activities in vitro were evaluated by MTT against three human cancer cell lines including HCT-116, U-87 MG and MCF-7 cell lines. The SAR of target compounds was preliminarily discussed. The compounds 1c and 2d with potent antiproliferative activities were tested for their effects on the AKT and p-AKT(473). The anticancer effect of 1c was evaluated in mice bearing sarcoma S-180 model. The results suggest that the title compounds are potent anticancer agents. (C) 2013 Elsevier Masson SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2013.06.052

文献信息

• Synthesis and anticancer activity evaluation of a series of [1,2,4]triazolo[1,5-a]pyridinylpyridines in vitro and in vivo
  作者：Xiao-Meng Wang、Jing Xu、Yi-Ping Li、Huan Li、Cong-Shan Jiang、Guang-De Yang、She-Min Lu、San-Qi Zhang

  DOI：10.1016/j.ejmech.2013.06.052

  日期：2013.9

  A series of [1,2,4]triazolo[1,5-a]pyridinylpyridines were synthesized and characterized. Their antiproliferative activities in vitro were evaluated by MTT against three human cancer cell lines including HCT-116, U-87 MG and MCF-7 cell lines. The SAR of target compounds was preliminarily discussed. The compounds 1c and 2d with potent antiproliferative activities were tested for their effects on the AKT and p-AKT(473). The anticancer effect of 1c was evaluated in mice bearing sarcoma S-180 model. The results suggest that the title compounds are potent anticancer agents. (C) 2013 Elsevier Masson SAS. All rights reserved.