2-{3-[Bis-(2-methoxy-ethyl)-amino]-isoxazol-5-yl}-5-methoxy-phenol | 247148-00-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 酚类
• 英文名称: 2-{3-[Bis-(2-methoxy-ethyl)-amino]-isoxazol-5-yl}-5-methoxy-phenol
• 英文别名: 2-[3-[Bis(2-methoxyethyl)amino]-1,2-oxazol-5-yl]-5-methoxyphenol
• CAS: 247148-00-1
• 化学式: C₁₆H₂₂N₂O₅
• 分子量: 322.361
• InChiKey: REHOXPYOTURDRN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.8
• 重原子数：
  23
• 可旋转键数：
  9
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.44
• 拓扑面积：
  77.2
• 氢给体数：
  1
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  2-{3-[Bis-(2-methoxy-ethyl)-amino]-isoxazol-5-yl}-5-methoxy-phenol 在 水 、 氢碘酸 作用下， 反应 0.5h， 以65%的产率得到2-[3-[Bis(2-hydroxyethyl)amino]-1,2-oxazol-5-yl]-5-methoxyphenol
  参考文献：
  名称：

  N,N-Dialkylaminosubstituted chromones and isoxazoles as potential anti-inflammatory agents

  摘要：

  The ability of some N,N-dialkylaminosubstituted chromones and isoxazoles to inhibit the protein kinase C (PKC) dependent signal transduction pathway was tested. As a cellular model, human neutrophils stimulated with either phorbol myristate acetate (PMA) or formylmethionine-leucine-phenylalanine (f-MLF) were used. The efficiency of the compounds was established by their capacity to reduce the O-2(-) production by activated human neutrophils. Compounds carrying a 3-bis(2-methoxyethyl)amino group, a substituent found active in previously tested tricyclic compounds, do not show significant anti-PKC activity in this study. On the other hand, substitution with a 1-piperidinyl group leads all tested compounds to a high biological activity against stimulated neutrophils. (C) 1999 Elsevier Science S.A. All rights reserved.

  DOI：

  10.1016/s0014-827x(99)00051-8
• 作为产物：
  描述：

  2-[Bis(2-methoxyethyl)amino]-7-methoxychromen-4-one 在 吡啶 、 盐酸羟胺 作用下， 以 乙醇 为溶剂， 反应 24.0h， 以75.2%的产率得到2-{3-[Bis-(2-methoxy-ethyl)-amino]-isoxazol-5-yl}-5-methoxy-phenol
  参考文献：
  名称：

  N,N-Dialkylaminosubstituted chromones and isoxazoles as potential anti-inflammatory agents

  摘要：

  The ability of some N,N-dialkylaminosubstituted chromones and isoxazoles to inhibit the protein kinase C (PKC) dependent signal transduction pathway was tested. As a cellular model, human neutrophils stimulated with either phorbol myristate acetate (PMA) or formylmethionine-leucine-phenylalanine (f-MLF) were used. The efficiency of the compounds was established by their capacity to reduce the O-2(-) production by activated human neutrophils. Compounds carrying a 3-bis(2-methoxyethyl)amino group, a substituent found active in previously tested tricyclic compounds, do not show significant anti-PKC activity in this study. On the other hand, substitution with a 1-piperidinyl group leads all tested compounds to a high biological activity against stimulated neutrophils. (C) 1999 Elsevier Science S.A. All rights reserved.

  DOI：

  10.1016/s0014-827x(99)00051-8