Tehran University of Medical Sciences

Science Communicator Platform

Stay connected! Follow us on X network (Twitter):
Share this content! By
Novel N,N-Dimethylbarbituric-Pyridinium Derivatives As Potent Urease Inhibitors: Synthesis, in Vitro, and in Silico Studies Publisher Pubmed



Biglar M1 ; Mirzazadeh R2 ; Asadi M3 ; Sepehri S4 ; Valizadeh Y1 ; Sarrafi Y5 ; Amanlou M3 ; Larijani B1 ; Mohammadikhanaposhtani M6 ; Mahdavi M1
Authors

Source: Bioorganic Chemistry Published:2020


Abstract

A new series of N,N-dimethylbarbituric-pyridinium derivatives 7a-n was synthesized and evaluated as Helicobacter pylori urease inhibitors. All the synthesized compounds (IC50 = 10.37 ± 1.0–77.52 ± 2.7 μM) were more potent than standard inhibitor hydroxyurea against urease (IC50 = 100.00 ± 0.2 μM). Furthermore, comparison of IC50 values of the synthesized compounds with the second standard inhibitor thiourea (IC50 = 22.0 ± 0.03 µM) revealed that compounds 7a-b and 7f-h were more potent than thiourea. Molecular modeling study of the most potent compounds 7a, 7b, 7f, and 7g was also conducted. Additionally, the drug-likeness properties of the synthesized compounds, based on Lipinski rule and other filters, were evaluated. © 2019
Related Docs
View other Related Docs
1. Arylmethylene Hydrazine Derivatives Containing 1,3-Dimethylbarbituric Moiety As Novel Urease Inhibitors, Scientific Reports (2021)
2. Novel (Thio)Barbituric-Phenoxy-N-Phenylacetamide Derivatives As Potent Urease Inhibitors: Synthesis, in Vitro Urease Inhibition, and in Silico Evaluations, Structural Chemistry (2021)
3. Synthesis and Urease Inhibitory Activity of Some 5-Aminomethylene Barbituric/Thiobarbituric Acid Derivatives, Letters in Drug Design and Discovery (2018)
Experts (# of related papers)
View all Related Experts
Massoud Amanlou (18)
Mohammad Mahdavi (13)
Other Related Docs
4. Design, Synthesis, Docking Study and Urease Inhibitory Activity Evaluation of Novel 2-((5-Amino-1,3,4-Thiadiazol-2-Yl)Thio)-N-Arylacetamide Derivatives, Medicinal Chemistry Research (2021)
5. Isoindolin-1-One Derivatives As Urease Inhibitors: Design, Synthesis, Biological Evaluation, Molecular Docking and In-Silico Adme Evaluation, Bioorganic Chemistry (2019)
6. Design and Synthesis of Novel Nitrothiazolacetamide Conjugated to Different Thioquinazolinone Derivatives As Anti-Urease Agents, Scientific Reports (2022)
7. Novel Phenylurea-Pyridinium Derivatives As Potent Urease Inhibitors: Synthesis, in Vitro, and in Silico Studies, Journal of Molecular Structure (2022)
8. [1,2,4]Triazolo[3,4-B][1,3,4]Thiadiazole Derivatives As New Therapeutic Candidates Against Urease Positive Microorganisms: Design, Synthesis, Pharmacological Evaluations, and in Silico Studies, Scientific Reports (2023)
9. Rational Design, Synthesis, Docking Simulation, and Admet Prediction of Novel Barbituric-Hydrazine-Phenoxy-1,2,3-Triazole-Acetamide Derivatives As Potent Urease Inhibitors, ChemistrySelect (2023)
10. Facile One-Pot Four-Component Synthesis of 3,4-Dihydro-2-Pyridone Derivatives: Novel Urease Inhibitor Scaffold, Research in Pharmaceutical Sciences (2017)
11. Synthesis, Biological Evaluation and Molecular Docking of Deferasirox and Substituted 1,2,4-Triazole Derivatives As Novel Potent Urease Inhibitors: Proposing Repositioning Candidate, Chemistry and Biodiversity (2020)
12. Design, Synthesis, in Vitro, and in Silico Investigations of New Barbituric Acid-Hydrazone-Chalcone Derivatives As Promising Urease Inhibitors, Journal of Molecular Structure (2025)
13. Piperazine-Based Semicarbazone Derivatives As Potent Urease Inhibitors: Design, Synthesis, and Bioactivity Screening, Letters in Drug Design and Discovery (2022)
14. New 1,2,3-Triazole–(Thio)Barbituric Acid Hybrids As Urease Inhibitors: Design, Synthesis, in Vitro Urease Inhibition, Docking Study, and Molecular Dynamic Simulation, Archiv der Pharmazie (2020)
15. Novel Benzimidazole Derivatives; Synthesis, Bioactivity and Molecular Docking Study As Potent Urease Inhibitors, DARU# Journal of Pharmaceutical Sciences (2022)
16. Cyanuric Chloride Mediated One-Pot Three-Component Reaction of Benzoylhydrazinyl-N-Alkyl Acetamide Derivatives As a New Urease Inhibitor Scaffold: Docking Study and Enzyme Inhibitory Activity, Pharmaceutical Chemistry Journal (2022)
17. The Most Up-To-Date Advancements in the Design and Development of Urease Inhibitors (January 2020-March 2024), Journal of Agricultural and Food Chemistry (2025)
18. Design, Synthesis, and Evaluation of Metronidazole-1,2,3-Triazole Derivatives As Potent Urease Inhibitors, Chemical Papers (2021)
19. Novel Coumarin-Based Acetohydrazide-1,2,3-Triazole Derivatives As Urease Enzyme Inhibitors: Synthesis, in Vitro Evaluation, and Molecular Dynamics Simulation Studies, Heliyon (2025)
20. New Thioxothiazolidinyl-Acetamides Derivatives As Potent Urease Inhibitors: Design, Synthesis, in Vitro Inhibition, and Molecular Dynamic Simulation, Scientific Reports (2023)