N4-{[4-(ammomethyl)cyclohexyl]methyl}-N2-[3-(difluoromethoxy)benzyl]-5-nitropyrimidine-2,4-diamine | 736052-01-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: N4-{[4-(ammomethyl)cyclohexyl]methyl}-N2-[3-(difluoromethoxy)benzyl]-5-nitropyrimidine-2,4-diamine
• 英文别名: N4-{[4-(aminomethyl)cyclohexyl]methyl}-N2-[3-(difluoromethoxy)benzyl]-5-nitropyrimidine-2,4-diamine；4-N-[[4-(aminomethyl)cyclohexyl]methyl]-2-N-[[3-(difluoromethoxy)phenyl]methyl]-5-nitropyrimidine-2,4-diamine
• CAS: 736052-01-0
• 化学式: C₂₀H₂₆F₂N₆O₃
• 分子量: 436.462
• InChiKey: ZDMVUTWZSPTYCU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  31
• 可旋转键数：
  9
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  131
• 氢给体数：
  3
• 氢受体数：
  10

文献信息

• COMPOSITIONS FOR MODULATING CANCER STEM CELLS AND USES THEREFOR
  申请人：University of Canberra

  公开号：EP3185858A1

  公开（公告）日：2017-07-05
• US7550473B2
  申请人：——

  公开号：US7550473B2

  公开（公告）日：2009-06-23
• [EN] COMPOSITIONS FOR MODULATING CANCER STEM CELLS AND USES THEREFOR<br/>[FR] COMPOSITIONS POUR MODULER LES CELLULES SOUCHES CANCÉREUSES ET LEURS UTILISATIONS
  申请人：UNIV CANBERRA

  公开号：WO2016029262A1

  公开（公告）日：2016-03-03

  Disclosed are compositions and methods for modulating cancer stem cells. More particularly, the present invention discloses the use of lysine demethylase (LSD) inhibitors and protein kinase C theta inhibitors (PKC-θ) for inhibiting the growth of LSD- and/or PKC-θ-overexpressing cells including cancer stem cells, for enhancing the biological effects of chemotherapeutic drugs or irradiation on cancer cells, for treating cancer, including non-metastatic and metastatic cancer and/or for preventing cancer recurrence.