6,6'-(methylenebis(3-(piperidin-1-yl)isoxazole-4,5-diyl))bis(3-methoxyphenol) | 623574-61-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 酚类
• 英文名称: 6,6'-(methylenebis(3-(piperidin-1-yl)isoxazole-4,5-diyl))bis(3-methoxyphenol)
• CAS: 623574-61-8
• 化学式: C₃₁H₃₆N₄O₆
• 分子量: 560.65
• InChiKey: NFDKSPIYCNGJDB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.0
• 重原子数：
  41.0
• 可旋转键数：
  8.0
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  117.46
• 氢给体数：
  2.0
• 氢受体数：
  10.0

反应信息

• 作为反应物：
  描述：

  硫酸二乙酯 、 6,6'-(methylenebis(3-(piperidin-1-yl)isoxazole-4,5-diyl))bis(3-methoxyphenol) 在 sodium hydroxide 作用下， 反应 3.0h， 以85.3%的产率得到
  参考文献：
  名称：

  Synthesis of 3,3′-(1-piperidino)substituted methylene-bis-isoxazoles preventing stimulus-induced leukocytes activation

  摘要：

  Some 3,3'-(1-piperidino)substituted methylene-bis-isoxazoles were prepared via Mannich base and tested to verify their antiinflammatory-related activity. Human neutrophils stimulated with either PMA and f-MLP were used as the cellular model. The efficiency of eight differently substituted compounds (2-9) was established on their capacity to reduce the O(2)(-) production by activated human neutrophils. The rising hydrophobicity in the side-chain of methylene-bis-isoxazoles leads to a distinction in the neutrophil response against the two stimuli, favoring the inhibition of the PMA elicited cell activation and leaving inaffected the f-MLP induced cell responses. Compounds 8 and 9 are particularly active and abolish almost completely the neutrophil activation in the presence of PMA stimulus.

  DOI：

  10.1016/s0014-827x(02)00008-3
• 作为产物：
  描述：

  7-methoxy-3-[(7-methoxy-4-oxo-2-piperidin-1-ylchromen-3-yl)methyl]-2-piperidin-1-ylchromen-4-one 在 吡啶 、 盐酸羟胺 作用下， 以 乙醇 为溶剂， 反应 24.0h， 以72.5%的产率得到6,6'-(methylenebis(3-(piperidin-1-yl)isoxazole-4,5-diyl))bis(3-methoxyphenol)
  参考文献：
  名称：

  Synthesis of 3,3′-(1-piperidino)substituted methylene-bis-isoxazoles preventing stimulus-induced leukocytes activation

  摘要：

  Some 3,3'-(1-piperidino)substituted methylene-bis-isoxazoles were prepared via Mannich base and tested to verify their antiinflammatory-related activity. Human neutrophils stimulated with either PMA and f-MLP were used as the cellular model. The efficiency of eight differently substituted compounds (2-9) was established on their capacity to reduce the O(2)(-) production by activated human neutrophils. The rising hydrophobicity in the side-chain of methylene-bis-isoxazoles leads to a distinction in the neutrophil response against the two stimuli, favoring the inhibition of the PMA elicited cell activation and leaving inaffected the f-MLP induced cell responses. Compounds 8 and 9 are particularly active and abolish almost completely the neutrophil activation in the presence of PMA stimulus.

  DOI：

  10.1016/s0014-827x(02)00008-3