Ethyl (4Z)-1-(4-ethoxyphenyl)-2-methyl-4-[(4-nitrophenyl)methylidene]-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯啉
• 英文名称: Ethyl (4Z)-1-(4-ethoxyphenyl)-2-methyl-4-[(4-nitrophenyl)methylidene]-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
• 英文别名: ethyl (4Z)-1-(4-ethoxyphenyl)-2-methyl-4-[(4-nitrophenyl)methylidene]-5-oxopyrrole-3-carboxylate
• 化学式: C23H22N2O6
• 分子量: 422.4
• InChiKey: JYAIHGSAYPJNDG-ZHZULCJRSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4
• 重原子数：
  31
• 可旋转键数：
  7
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  102
• 氢给体数：
  0
• 氢受体数：
  6

文献信息

• Inhibitors Targeting the DNA-Binding Domain of Human STAT3 for Treatment of Metastatic Cancers
  申请人：Zhang Jian-Ting

  公开号：US20150094353A1

  公开（公告）日：2015-04-02

  The present invention provides STAT3 inhibitors which preferentially suppress proliferation of cancer over non-cancer cells and inhibit migration and invasion of malignant cells. The inhibitors of the present invention selectively inhibit STAT3 binding to DNA without affecting the activation and dimerization of STAT3. Furthermore, the inhibitors of the present invention inhibit expression of STAT3 downstream target genes and STAT3 binding to chromatin in situ.
• US9382204B2
  申请人：——

  公开号：US9382204B2

  公开（公告）日：2016-07-05