2-((2-(methylamino)ethylimino)methyl)-6-methoxyphenol | 110881-37-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 酚类
• 英文名称: 2-((2-(methylamino)ethylimino)methyl)-6-methoxyphenol
• 英文别名: 2-methoxy-6-[(2-methylaminoethylimino)methyl]phenol；2-Methoxy-6-[2-(methylamino)ethyliminomethyl]phenol
• CAS: 110881-37-3
• 化学式: C₁₁H₁₆N₂O₂
• 分子量: 208.26
• InChiKey: OADQMFAHYRJMNP-UHFFFAOYSA-N

物化性质

• 沸点：
  336.1±42.0 °C(Predicted)
• 密度：
  1.08±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.5
• 重原子数：
  15
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  53.8
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  2-((2-(methylamino)ethylimino)methyl)-6-methoxyphenol 、 bis(acetylacetonato) oxovanadium(IV) 以 甲醇 为溶剂， 以72%的产率得到bis(μ2-oxo)bis(2-methoxy-6-[(2-methylaminoethylimino)methyl]phenoato)dioxovanadium(V)
  参考文献：
  名称：

  Synthesis, structures, and urease inhibitory activities of oxovanadium(V) complexes with Schiff bases

  摘要：

  A series of oxovanadium(V) complexes, [VO2L1](2) (1), [VO2L2](2) (2), [VO2L3](2) (3), [VO2L4](2) (4), [VO(OCH3)L-5] (5), and [VO(OCH3)(HOCH3)L-6] (6) (HL1 = 2-ethoxy-6-{[2-(2-hydroxyethylamino)ethylimino]methyl} phenol, HL2 = 4-chloro-2-{[2-(2-hydroxyethylamino)ethylimino]methyl}phenol, HL3 = 2-methoxy-6-[(2-methylaminoethylimino)methyl]phenol, HL4 = 4-chloro-2-[(2-methylaminoethylimino) methyl] phenol, HL5 = N'-(2-hydroxy-3-ethoxybenzylidene)-3-hydroxy-2-naphthohydrazide, and HL6 = N'-(2-hydroxy-5-chlorobenzylidene)-3-hydroxy-2-naphthohydrazide), have been prepared and structurally characterized by physico-chemical methods and X-ray diffraction. The inhibition rates (%) with the concentration of 100 mu M for the complexes on Helicobacter pylori urease are 18.96 +/- 0.44 (1), 33.01 +/- 1.80 (2), 35.83 +/- 0.78 (3), 48.09 +/- 1.23 (4), 45.91 +/- 2.09 (5), and 90.72 +/- 1.91 (6). The relationship between the structures and urease inhibitory activities indicates that the chloro-substituted complexes have stronger activity than the alk-oxy-substituted complexes. It is notable that one of the chloro-substituted complexes has very strong urease inhibitory activity, with IC50 value of 17.35 +/- 1.01 mu M, which is much lower than that of the acetohydroxamic acid coassayed as a standard urease inhibitor. The kinetic studies reveal that the complex is a mixed-competitive inhibitor of urease. The molecular docking study of the complexes with the Helicobacter pylori urease was performed. (C) 2011 Elsevier B. V. All rights reserved.

  DOI：

  10.1016/j.ica.2011.11.039
• 作为产物：
  描述：

  邻香草醛 、 N-甲基乙二胺 以 甲醇 为溶剂， 反应 1.0h， 生成 2-((2-(methylamino)ethylimino)methyl)-6-methoxyphenol
  参考文献：
  名称：

  通过原位1,3-偶极环加成反应形成具有N，N，O供体席夫碱 的bis（μ-四唑酮）dinickel（ii）配合物：新型双环三核镍（ii）-钠（）的分离i）-镍（ii）配合物†

  摘要：

  双核和新型双环杂三核双（μ-四唑olato）桥接镍（II）Schiff碱配合物[Ni 2（L 1）2（PTZ）2 ]（1）和[Ni 2（L 2）2（ PTZ）2 Na（H 2 O）] ClO 4 ·H 2 O（2）{其中HL 1 = 2-（（（2-（二甲基氨基）乙基亚氨基）甲基）-6-甲氧基苯酚，HL 2 = 2-（（2 -（甲基氨基）乙基亚氨基）甲基）-6-甲氧基苯酚和HPTZ = 5-（2-吡啶基）四唑}是通过原位合成的1,3-偶极环加成，并通过光谱分析，X射线晶体学和可变温度磁化率测量进行表征。两种络合物均在单斜空间群P 2 1 / c中结晶。两种配合物均具有双重的μ-NN'-四唑桥连双dinickel（II）结构，其中每个镍（II）通过去离子的齿状Schiff碱[（L 1）-表示1和（L 2）-表示2代经络配位。]和（PTZ）-的两个氮原子。来自对称相关桥（PTZ）的氮原子-坐标以

  DOI：

  10.1039/c3dt52796d

文献信息

• Bis(μ-tetrazolato-NN′) bridged dinuclear nickel(II) Schiff base complexes: Tandem synthesis, structure and self assembly
  作者：Mithun Das、Klaus Harms、Biswa Nath Ghosh、Kari Rissanen、Shouvik Chattopadhyay

  DOI：10.1016/j.poly.2014.11.012

  日期：2015.2

  in presence of nickel(II) acetate tetrahydrate and the respective Schiff bases. The structures of the complexes are confirmed by single crystal X-ray diffraction analysis. Both complexes show fluorescence. The change in the denticity of the Schiff base blocking ligand is shown to have no effect in controlling the molecular structures of the complexes. The supramolecular self assemblies are also explored

  Two new bis(μ-tetrazolato-NN′) bridged dinuclear nickel(II) Schiff base complexes [Ni2L12(PTZ)2]·2(CH3)2SO·2.69H2O (1) and 2[Ni2L22(PTZ)2]·3H2O (2) (HL1 and HL2 are Schiff bases, HL1 = 2-((2-(dimethylamino)ethylimino)methyl)phenol, HL 2  =  2-（（（2-（甲基氨基）乙基亚氨基）甲基）-6-甲氧基苯酚，HPTZ为5-吡嗪基四唑）是通过在镍存在下通过2-氰基吡嗪和叠氮化钠的[3 + 2]环加成反应合成的（II）乙酸四水合物和各自的席夫碱。配合物的结构通过单晶X射线衍射分析确认。两种复合物均显示荧光。Schiff碱封闭配体的密度变化表明对控制复合物的分子结构没有影响。还探讨了超分子自组装。