2-((2-(5-(2-chlorophenyl)-4-((2-hydroxybenzylidene)amino)-4H-1,2,4-triazol-3-yl)hydrazineylidene)methyl)phenol | 1185757-29-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 2-((2-(5-(2-chlorophenyl)-4-((2-hydroxybenzylidene)amino)-4H-1,2,4-triazol-3-yl)hydrazineylidene)methyl)phenol
• CAS: 1185757-29-2
• 化学式: C₂₂H₁₇ClN₆O₂
• 分子量: 432.869
• InChiKey: GUUBJQUCPXDRTR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.34
• 重原子数：
  31.0
• 可旋转键数：
  6.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  107.92
• 氢给体数：
  3.0
• 氢受体数：
  8.0

反应信息

• 作为反应物：
  描述：

  zinc(II) acetate dihydrate 、 2-((2-(5-(2-chlorophenyl)-4-((2-hydroxybenzylidene)amino)-4H-1,2,4-triazol-3-yl)hydrazineylidene)methyl)phenol 在 sodium acetate 作用下， 以 乙醇 为溶剂， 以75%的产率得到
  参考文献：
  名称：

  Synthesis and spectral characterization of Zn(II) microsphere series for antimicrobial application

  摘要：

  Microsphere series have been synthesized by reacting zinc(II) acetate dihydrate with Schiff bases derived from 2-hydrazino-5-[substituted phenyl]-1,3,4-thiadiazole/oxadiazole/triazole with salicylaldehyde. Elemental analysis suggests that the complexes have 1:2 and 1:1 stoichiometry of the type [Zn(L)(2)(H2O)(2)] and [Zn(L')(2)(H2O)(2)]; LH = Schiff bases derived from 2-hydrazino-5-[substituted phenyl]-1,3,4-thia/oxadiazole with salicylaldehyde; L'H-2 = Schiff bases derived from 3-(substituted phenyl)-4-amino-5-hydrazino-1,2,4-triazole and salicylaldehyde and were characterized by elemental analyses, IR, H-1 NMR and C-13 NMR spectral data. Scanning electron microscopy (SEM) showed that synthesized materials have microsphere like structure and there EDX analysis comparably matches with elemental analysis. For the antimicrobial application Schiff bases and their zinc(II) complexes were screened for four bacteria e.g. Bacillus subtilis, Pseudomonas aeruginosa, Salmonella typhi, Streptococcus pyogenes and four fungi e.g. Cyrtomium falcatum, Aspergillus niger, Fusarium oxysporium and Curvularia pallescence by the reported method. Schiff base and Zn(II) compounds showed significant antimicrobial activities. However, activities increase upon chelation. Thermal analysis (TGA) data of compound (10) showed its stability up to 300 degrees C. (C) 2014 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.molstruc.2014.06.009
• 作为产物：
  描述：

  2-氯苯甲酰肼 在 hydrazine hydrate monohydrate 、 硫酸 、 potassium hydroxide 作用下， 以 乙醇 为溶剂， 生成 2-((2-(5-(2-chlorophenyl)-4-((2-hydroxybenzylidene)amino)-4H-1,2,4-triazol-3-yl)hydrazineylidene)methyl)phenol
  参考文献：
  名称：

  Synthesis and spectral characterization of Zn(II) microsphere series for antimicrobial application

  摘要：

  Microsphere series have been synthesized by reacting zinc(II) acetate dihydrate with Schiff bases derived from 2-hydrazino-5-[substituted phenyl]-1,3,4-thiadiazole/oxadiazole/triazole with salicylaldehyde. Elemental analysis suggests that the complexes have 1:2 and 1:1 stoichiometry of the type [Zn(L)(2)(H2O)(2)] and [Zn(L')(2)(H2O)(2)]; LH = Schiff bases derived from 2-hydrazino-5-[substituted phenyl]-1,3,4-thia/oxadiazole with salicylaldehyde; L'H-2 = Schiff bases derived from 3-(substituted phenyl)-4-amino-5-hydrazino-1,2,4-triazole and salicylaldehyde and were characterized by elemental analyses, IR, H-1 NMR and C-13 NMR spectral data. Scanning electron microscopy (SEM) showed that synthesized materials have microsphere like structure and there EDX analysis comparably matches with elemental analysis. For the antimicrobial application Schiff bases and their zinc(II) complexes were screened for four bacteria e.g. Bacillus subtilis, Pseudomonas aeruginosa, Salmonella typhi, Streptococcus pyogenes and four fungi e.g. Cyrtomium falcatum, Aspergillus niger, Fusarium oxysporium and Curvularia pallescence by the reported method. Schiff base and Zn(II) compounds showed significant antimicrobial activities. However, activities increase upon chelation. Thermal analysis (TGA) data of compound (10) showed its stability up to 300 degrees C. (C) 2014 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.molstruc.2014.06.009

文献信息

• Synthesis, Structural Investigation and Antimicrobial Properties of Macrocyclic Zinc(II) Complexes with N2O2-Donor Schiff Bases Incorporating 1,2,4-Triazole Ring
  作者：Vishwkarma, Arti、Srivastava, Akhilesh K.、Pandey, Om P.、Sengupta, Soumitra K.

  DOI：10.14233/ajchem.2020.22959

  日期：——

  A novel series of nano-sized zinc(II) complexes of type [Zn(M)(H2O)2}(CH3COO–)2] (where M = macrocyclic ligands) has been synthesized by the in situ reactions of Schiff bases derived from 3-(phenyl/substituted phenyl)-4-amino-5-hydrazino-1,2,4-triazoles, salicyldehyde/2-hydroxy-1- naphthaldehyde and 1,4-dibromobutane/1,5-dibromopentane in presence of zinc(II) acetate dihydrate in absolute ethanol

  通过席夫碱的原位反应合成了一系列新型纳米锌 (II) 配合物 [Zn(M)(H2O)2}(CH3COO–)2]（其中 M = 大环配体）由3-(苯基/取代苯基)-4-氨基-5-肼基-1,2,4-三唑、水杨醛/2-羟基-1-萘醛和1,4-二溴丁烷/1,5-二溴戊烷在存在下制备无水乙醇中的二水合乙酸锌(II)。所有这些锌(II)络合物的结构都是根据元素分析和光谱数据（IR、1H NMR 和 13C NMR）确定的。扫描电子显微镜研究旨在研究特定复合物的粒径和表面形态，而热研究证实所有锌 (II) 复合物中都存在配位水分子。研究了所有合成的复合物对不同种类的病原真菌和细菌的抗菌作用。