[1-(4-Morpholin-4-ylphenyl)ethylideneamino]urea | 216875-26-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 恶嗪烷类
• 英文名称: [1-(4-Morpholin-4-ylphenyl)ethylideneamino]urea
• CAS: 216875-26-2
• 化学式: C₁₃H₁₈N₄O₂
• 分子量: 262.312
• InChiKey: UMMWOQUILXEIQM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.6
• 重原子数：
  19
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  80
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  N,N-二甲基甲酰胺 、 [1-(4-Morpholin-4-ylphenyl)ethylideneamino]urea 在 三氯氧磷 、 sodium hydroxide 、 水 作用下， 生成
  参考文献：
  名称：

  Structure–activity relationship study of a novel necroptosis inhibitor, necrostatin-7

  摘要：

  Necroptosis is a regulated caspase-independent cell death mechanism characterized by morphological features resembling non-regulated necrosis. Necrotatin-7 (Nec-7), a novel potent small-molecule inhibitor of necroptosis, is structurally distinct from previously described necrostatins (Nec-1, Nec-3, Nec-4 and Nec-5). Here, we describe a series of structural modi. cations and the structure-activity relationship (SAR) of the Nec-7 series for inhibiting necroptosis. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.08.058
• 作为产物：
  描述：

  4-(4-吗啉基)苯乙酮 、 盐酸氨基脲 在 sodium acetate 作用下， 以 甲醇 、 水 为溶剂， 生成 [1-(4-Morpholin-4-ylphenyl)ethylideneamino]urea
  参考文献：
  名称：

  Structure–activity relationship study of a novel necroptosis inhibitor, necrostatin-7

  摘要：

  Necroptosis is a regulated caspase-independent cell death mechanism characterized by morphological features resembling non-regulated necrosis. Necrotatin-7 (Nec-7), a novel potent small-molecule inhibitor of necroptosis, is structurally distinct from previously described necrostatins (Nec-1, Nec-3, Nec-4 and Nec-5). Here, we describe a series of structural modi. cations and the structure-activity relationship (SAR) of the Nec-7 series for inhibiting necroptosis. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.08.058