相关参考文献
注意:仅列出部分参考文献,下载原文获取全部文献信息。Docking of disordered independent molecules of novel crystal structure of (N-(4-methoxyphenyl)-2-(3-methyl-2-oxo-3,4-dihydroquinoxalin-1(2H)-yl)acetamide as anti-COVID-19 and anti-Alzheimer's disease. Crystal structure, HSA/DFT/XRD
Mohcine Missioui et al.
JOURNAL OF MOLECULAR STRUCTURE (2022)
[Cu(dipicolinoylamide)(NO3)(H2O)] as anti-COVID-19 and antibacterial drug candidate: Design, synthesis, crystal structure, DFT and molecular docking
Laila H. Abdel-Rahman et al.
JOURNAL OF MOLECULAR STRUCTURE (2022)
Synthesis, crystal structure, DFT calculations, Hirshfeld surface analysis, energy frameworks, molecular dynamics and docking studies of novel isoxazolequinoxaline derivative (IZQ) as anti-cancer drug
Nadeem Abad et al.
JOURNAL OF MOLECULAR STRUCTURE (2021)
Quinoxaline derivatives as efficient corrosion inhibitors: Current status, challenges and future perspectives
Dheeraj Singh Chauhan et al.
JOURNAL OF MOLECULAR LIQUIDS (2020)
Synthesis, crystal structure, hirshfeld surface analysis, DFT computations and molecular dynamics study of 2-(benzyloxy)-3-phenylquinoxaline
Nadeem Abad et al.
JOURNAL OF MOLECULAR STRUCTURE (2020)
Experimental and density functional theory (MEP, FMO, NLO, Fukui functions) and antibacterial activity studies on 2-amino-4-(4-nitrophenyl)-5,6-dihydrobenzo [h] quinoline-3-carbonitrile
Serap Uzun et al.
JOURNAL OF MOLECULAR STRUCTURE (2019)
Dansyl azide as a selective fluorescence tagging probe for click chemistry reactions and its application to monitor rasagiline in pharmacokinetic studies
Sameh Ahmed et al.
JOURNAL OF PHARMACEUTICAL AND BIOMEDICAL ANALYSIS (2019)
The first example of a click reaction with a carboranyl azide and an olefin
Uday B. Chauhan et al.
TETRAHEDRON (2019)
Divergent synthesis of chiral cyclic azides via asymmetric cycloaddition reactions of vinyl azides
Nuligonda Thirupathi et al.
NATURE COMMUNICATIONS (2019)
Synthesis, crystal structure, DFT calculations, Hirshfeld surface, vibrational and optical properties of a novel hybrid non-centrosymmetric material (C10H15N2)2H2P2O7
Yathreb Oueslati et al.
JOURNAL OF MOLECULAR STRUCTURE (2019)
On the understanding of the adsorption of Fenugreek gum on mild steel in an acidic medium: Insights from experimental and computational studies
Hassane Lgaz et al.
APPLIED SURFACE SCIENCE (2019)
Modified ribavirin analogues as antiviral agents against Junin virus
Mario Contin et al.
BIOORGANIC & MEDICINAL CHEMISTRY LETTERS (2019)
Theoretical investigation of N-trans-cinnamylidene-m-toluidine by DFT method and molecular docking studies
Nilgun Ataunal Ancin et al.
JOURNAL OF MOLECULAR STRUCTURE (2019)
Synthesis, DFT and POM analyses of cytotoxicity activity of α-camidophosphonates derivatives: Identification of potential antiviral O,O-pharmacophore site
Khadidja Otmane Rachedi et al.
JOURNAL OF MOLECULAR STRUCTURE (2019)
Synthesis, structural and molecular characterization of 2,2-diphenyl-2H,3H,5H,6H,7H-imidazo[2,1-b][1,3]thiazin-3-one
Walid Guerrab et al.
JOURNAL OF MOLECULAR STRUCTURE (2019)
Progress in intermolecular and intramolecular reactions of thioamides with diazo compounds and azides
Vasiliy Bakulev et al.
TETRAHEDRON LETTERS (2019)
Direct access to poly(glycidyl azide) and its copolymers through anionic (co-)polymerization of glycidyl azide
Senthil K. Boopathi et al.
NATURE COMMUNICATIONS (2019)
Quantum mechanical, spectroscopic study (FT-IR and FT - Raman), NBO analysis, HOMO-LUMO, first order hyperpolarizability and docking studies of a non-steroidal anti-inflammatory compound
S. Sakthivel et al.
JOURNAL OF MOLECULAR STRUCTURE (2018)
Quantum chemical calculations, molecular dynamic (MD) simulations and experimental studies of using some azo dyes as corrosion inhibitors for iron. Part 2: Bis-azo dye derivatives
Loutfy H. Madkour et al.
JOURNAL OF MOLECULAR STRUCTURE (2018)
Synthesis and antioxidant action of chitosan derivatives with amino-containing groups via azide-alkyne click reaction and N-methylation
Wenqiang Tan et al.
CARBOHYDRATE POLYMERS (2018)
Experimental and theoretical investigation of the inhibitory effect of new pyridazine derivatives for the corrosion of mild steel in 1 M HCl
Motsie E. Mashuga et al.
JOURNAL OF MOLECULAR STRUCTURE (2017)
A computational study on corrosion inhibition performances of novel quinoline derivatives against the corrosion of iron
Saban Erdogan et al.
JOURNAL OF MOLECULAR STRUCTURE (2017)
Experimental and theoretical studies for mild steel corrosion inhibition in 1.0 M HCl by three new quinoxalinone derivatives
A. Tazouti et al.
JOURNAL OF MOLECULAR LIQUIDS (2016)
Vibrational spectroscopic studies, Fukui functions, HOMO-LUMO, NLO, NBO analysis and molecular docking study of (E)-1-(1,3-benzodioxol-5-yl)-4,4-dimethylpent-1-en-3-one, a potential precursor to bioactive agents
Reem I. Al-Wabli et al.
JOURNAL OF MOLECULAR STRUCTURE (2016)
Correlating electronic structure with corrosion inhibition potentiality of some bis-benzimidazole derivatives for mild steel in hydrochloric acid: Combined experimental and theoretical studies
Alokdut Dutta et al.
CORROSION SCIENCE (2015)
Reactivities of vinyl azides and their recent applications in nitrogen heterocycle synthesis
Bao Hu et al.
ORGANIC & BIOMOLECULAR CHEMISTRY (2015)
Density functional theory and molecular dynamics simulation study on corrosion inhibition performance of mild steel by mercapto-quinoline Schiff base corrosion inhibitor
Sourav Kr. Saha et al.
PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES (2015)
Theoretical evaluation of corrosion inhibition performance of three antipyrine compounds
Hongfu Mi et al.
COMPUTATIONAL AND THEORETICAL CHEMISTRY (2015)
An empirical correction for the influence of low-energy contamination
Lennard Krause et al.
JOURNAL OF APPLIED CRYSTALLOGRAPHY (2015)
Molecular dynamics simulation and quantum chemical calculations for the adsorption of some Azo-azomethine derivatives on mild steel
H. Shokry
JOURNAL OF MOLECULAR STRUCTURE (2014)
Pharmacological Profile of Quinoxalinone
Youssef Ramli et al.
JOURNAL OF CHEMISTRY (2014)
SHELXT: Integrating space group determination and structure solution
G. Sheldrick
ACTA CRYSTALLOGRAPHICA A-FOUNDATION AND ADVANCES (2014)
On the Unique Reactivity of Pd(OAc)2 with Organic Azides: Expedient Synthesis of Nitriles and Imines
Laura Martinez-Sarti et al.
CHEMCATCHEM (2013)
New 3-methylquinoxaline-2-carboxamide 1,4-di-N-oxide derivatives as anti-Mycobacterium tuberculosis agents
Saioa Ancizu et al.
BIOORGANIC & MEDICINAL CHEMISTRY (2010)
Recent advances in transition metal-catalyzed N-atom transfer reactions of azides
Tom G. Driver
ORGANIC & BIOMOLECULAR CHEMISTRY (2010)
3-Methyl-1-propargylquinoxalin-2(1H)-one
Hanane Benzeid et al.
ACTA CRYSTALLOGRAPHICA SECTION E-STRUCTURE REPORTS ONLINE (2009)
Synthesis and antitumor activity studies of some new fused 1,2,4-triazole derivatives carrying 2,4-dichloro-5-fluorophenyl moiety
K. Subrahmanya Bhat et al.
EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY (2009)
Design, synthesis and molecular modeling study of acylated 1,2,4-triazole-3-acetates with potential anti-inflammatory activity
Ashraf M. Abdel-Megeed et al.
EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY (2009)
Efficient synthesis of sulfonyl azides from sulfonamides
Jessica Raushel et al.
ORGANIC LETTERS (2008)
2,3-quinoxalinedione as a novel corrosion inhibitor for mild steel in 1 M HCl
Y. Abboud et al.
MATERIALS CHEMISTRY AND PHYSICS (2007)
An efficient, inexpensive, and shelf-stable diazotransfer reagent: Imidazole-1-sulfonyl azide hydrochloride
Ethan D. Goddard-Borger et al.
ORGANIC LETTERS (2007)
Theoretical support for using the Δf(r) descriptor
Christophe Morell et al.
CHEMICAL PHYSICS LETTERS (2006)
Synthesis and antiprotozoal activity of some new synthetic substituted quinoxalines
X Hui et al.
BIOORGANIC & MEDICINAL CHEMISTRY LETTERS (2006)
Coordination chemistry of organic azides and amination reactions catalyzed by transition metal complexes
Sergio Cenini et al.
COORDINATION CHEMISTRY REVIEWS (2006)
Electrophilicity index
Pratim Kumar Chattaraj et al.
CHEMICAL REVIEWS (2006)
Synthesis and pharmacological evaluation of substituted 5-[4-[2-(6,7-dimethyl-1,2,3,4-tetrahydro-2-oxo-4-quinoxalinyl)ethoxylphenyllmethylenelthiazolidine-2,4-dione derivatives as potent euglycemic and hypolipidemic agents
D Gupta et al.
BIOORGANIC & MEDICINAL CHEMISTRY LETTERS (2005)
Organic azides: An exploding diversity of a unique class of compounds
S Brase et al.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2005)
The growing impact of click chemistry on drug discovery
HC Kolb et al.
DRUG DISCOVERY TODAY (2003)
Synthesis and in vitro antibacterial evaluation of N-[5-(5-vitro-2-thienyl)-1, 3,4-thiadiazole-2-yl] piperazinyl quinolones
A Foroumadi et al.
EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY (2003)
Synthesis characterization and anticancer activity studies on some Mannich bases derived from 1,2,4-triazoles
BS Holla et al.
EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY (2003)
Synthesis of certain substituted quinoxalines as antimicrobial agents (part II)
MM Badran et al.
ARCHIVES OF PHARMACAL RESEARCH (2003)
Novel functionalized pyrido[2,3-g]quinoxalinones as antibacterial, antifungal and anticancer agents
A Carta et al.
FARMACO (2001)