Suppr超能文献

一种新型水合结晶形式的 -[()-(4-羟基-苯基)亚甲基]-1,2,4-三唑-3-胺及其抗真菌活性。

A new hydrated crystalline form of -[()-(4-hy-droxy-phen-yl)methyl-idene]-1-1,2,4-triazol-3-amine and its anti-fungal activity.

作者信息

Boutheina Boualia, Zakaria Bouhidel, Cherouana Aouatef, El-Eulmi Bendeif

机构信息

Unité de Recherche de Chimie de l'Environnement et Moléculaire Structurale (URCHEMS) Département de Chimie Université Mentouri de Constantine 25000 Constantine Algeria.

Synchrotron SOLEIL, L'Orme des Merisiers, BP48, Saint Aubin, 91192, Gif-sur-Yvette, France.

出版信息

Acta Crystallogr E Crystallogr Commun. 2025 Jan 1;81(Pt 1):80-84. doi: 10.1107/S205698902401209X.

Abstract

The synthesis, crystal structure, Hirshfeld analysis, and anti-fungal assessment of a new monohydrated Schiff base with a triazole moiety are reported. The structural study revealed the presence of three significant hydrogen bonds (N-H⋯N, O-H⋯N, and O-H⋯O), which contribute to the cohesion of the crystal. These bonds generate two-dimensional layers parallel to the plane, built on the basis of rings with the graph-set motifs (8) and (24). The crystal structure is further consolidated by π-π inter-actions between similar rings. The anti-fungal activity of the Schiff base was evaluated against three fungi: , , and , showing significant anti-fungal activity, particularly against .

摘要

报道了一种含三唑部分的新型一水合席夫碱的合成、晶体结构、 Hirshfeld分析和抗真菌评估。结构研究表明存在三种重要的氢键(N-H⋯N、O-H⋯N和O-H⋯O),这有助于晶体的凝聚。这些键形成平行于 平面的二维层,基于具有图集模式 (8)和 (24)的环构建。晶体结构通过相似环之间的π-π相互作用进一步巩固。评估了席夫碱对三种真菌: 、 和 的抗真菌活性,显示出显著的抗真菌活性,特别是对 。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/1da2/11701766/6db6ee20d2ab/e-81-00080-fig1.jpg

相似文献

1
A new hydrated crystalline form of -[()-(4-hy-droxy-phen-yl)methyl-idene]-1-1,2,4-triazol-3-amine and its anti-fungal activity.
Acta Crystallogr E Crystallogr Commun. 2025 Jan 1;81(Pt 1):80-84. doi: 10.1107/S205698902401209X.
2
Crystal structure of (E)-3-(4-hy-droxy-benz-yl)-4-{[4-(methyl-sulfan-yl)benzyl-idene]amino}-1H-1,2,4-triazole-5(4H)-thione.
Acta Crystallogr E Crystallogr Commun. 2015 Nov 21;71(Pt 12):o982-3. doi: 10.1107/S2056989015021994. eCollection 2015 Dec 1.
3
1-{()-[4-(4-Hy-droxy-phen-yl)butan-2-yl-idene]amino}-3-phenyl-thio-urea: crystal structure, Hirshfeld surface analysis and computational study.
Acta Crystallogr E Crystallogr Commun. 2021 Jul 13;77(Pt 8):788-794. doi: 10.1107/S2056989021006666. eCollection 2021 Aug 1.
4
Crystal structure and Hirshfeld surface analysis of ()-4-{[2-(4-hy-droxy-benzo-yl)hydrazin-1-yl-idene]meth-yl}pyridin-1-ium nitrate.
Acta Crystallogr E Crystallogr Commun. 2018 Feb 7;74(Pt 3):323-327. doi: 10.1107/S2056989018002141. eCollection 2018 Mar 1.
5
Crystal structure and Hirshfeld surface analysis of ()-4-(4-hy-droxy-benzyl-idene)-3-methyl-isoxazol-5(4)-one.
Acta Crystallogr E Crystallogr Commun. 2018 Jun 8;74(Pt 7):926-930. doi: 10.1107/S2056989018007867. eCollection 2018 Jul 1.
6
9
Crystal structure and Hirshfeld surface analysis of ,'-bis-(3--butyl-2-hy-droxy-5-methyl-benzyl-idene)ethane-1,2-di-amine.
Acta Crystallogr E Crystallogr Commun. 2018 Jul 24;74(Pt 8):1147-1150. doi: 10.1107/S2056989018009726. eCollection 2018 Aug 1.
10
Synthesis and crystal structure of 2-(2,4-dioxo-6-methyl-pyran-3-yl-idene)-4-(4-hy-droxy-phen-yl)-2,3,4,5-tetra-hydro-1-1,5-benzodiazepine.
Acta Crystallogr E Crystallogr Commun. 2025 Apr 8;81(Pt 5):381-384. doi: 10.1107/S2056989025003032. eCollection 2025 May 1.

本文引用的文献

1
2-Hy-droxy-benzenaminium acetate.
IUCrdata. 2022 Feb 3;7(Pt 2):x220112. doi: 10.1107/S2414314622001122. eCollection 2022 Feb.
2
Crystal structure and Hirshfeld surface analysis of 2-(2-hy-droxy-phen-yl)quinoline-6-sulfonamide.
Acta Crystallogr E Crystallogr Commun. 2022 Mar 17;78(Pt 4):409-413. doi: 10.1107/S2056989022002870. eCollection 2022 Apr 1.
3
: a program for Hirshfeld surface analysis, visualization and quantitative analysis of molecular crystals.
J Appl Crystallogr. 2021 Apr 27;54(Pt 3):1006-1011. doi: 10.1107/S1600576721002910. eCollection 2021 Jun 1.
6
The Cambridge Structural Database.
Acta Crystallogr B Struct Sci Cryst Eng Mater. 2016 Apr;72(Pt 2):171-9. doi: 10.1107/S2052520616003954. Epub 2016 Apr 1.
7
Posaconazole: a potent, extended-spectrum triazole anti-fungal for the treatment of serious fungal infections.
Int J Clin Pract. 2004 Jun;58(6):612-24. doi: 10.1111/j.1368-5031.2004.00167.x.
8
Graph-set analysis of hydrogen-bond patterns in organic crystals.
Acta Crystallogr B. 1990 Apr 1;46 ( Pt 2):256-62. doi: 10.1107/s0108768189012929.

文献AI研究员

20分钟写一篇综述,助力文献阅读效率提升50倍。

立即体验

用中文搜PubMed

大模型驱动的PubMed中文搜索引擎

马上搜索

文档翻译

学术文献翻译模型,支持多种主流文档格式。

立即体验