A5085529255- Quinazolinone synthesis and applications
- Synthesis and Characterization of Heterocyclic Compounds
- Phenothiazines and Benzothiazines Synthesis and Activities
- Prion Diseases and Protein Misfolding
- Amino Acid Enzymes and Metabolism
- Chemical synthesis and alkaloids
- Trace Elements in Health
- Steroid Chemistry and Biochemistry
- Cholinesterase and Neurodegenerative Diseases
- Computational Drug Discovery Methods
- Neurological diseases and metabolism
- DNA and Nucleic Acid Chemistry
- Enzyme Structure and Function
- Metal complexes synthesis and properties
- Pharmacological Receptor Mechanisms and Effects
University of Trento
2022-2025
Abstract Copper (Cu) is a vitally important micronutrient, whose balance between essential and toxic levels requires tightly regulated network of proteins. Dysfunction in key components this leads to the disruption Cu homeostasis, resulting fatal disorders such as Wilson disease, which caused by mutations hepatic efflux transporter ATP7B. Unfortunately, molecular targets for normalizing homeostasis disease remain poorly understood. Here, using genome-wide screening, we identified cellular...
In the search for fused heterocycle molecules with potential biological activities, new title compound was produced in racemic form via a four step-synthetic sequence an overall yield of 60%. It structurally characterised 1H-, 13C-NMR and IR analyses, molecular composition confirmed through high-resolution MS experiment. After predicting its analgesic activity using PASS online software, wherein good overlap between enantiomers structure natural opioid morphine observed, evaluated docking...
In this study, Antarctic Latrunculia sponge-derived discorhabdin G was considered a hit for developing potential lead compounds acting as cholinesterase inhibitors. The hypothesis on the pharmacophore moiety suggested through molecular docking allowed us to simplify structure of metabolite. ADME prediction and drug-likeness consideration provided valuable support in selecting 5-methyl-2H-benzo[h]imidazo[1,5,4-de]quinoxalin-7(3H)-one candidate molecule. It synthesized four-step sequence...
With the aim to produce new heterocycle molecules, previously reported 2-(aminomethyl)-2-(4-chlorophenyl)-2,3-dihydroquinazolin-4(1H)-one was converted efficiently by reacting with N,N’-dithiocarbonyldiimidazole (DTCI), substituted imidazolidine-2-thione moiety inserted in a three fused ring scaffold of title compound. The molecular composition confirmed high-resolution MS experiment, and its structure elucidated 1H, 13CNMR, IR analyses. thioacetamide form product supported density...
(1R,5S)-1-Hydroxy-3,6-dioxa-bicyclo[3.2.1]octan-2-one, available by an efficient catalytic pyrolysis of cellulose, has been applied as a chiral building block in the synthesis seven new nucleoside analogues, with structural modifications on nucleobase moiety and carboxyl- derived unit. The inverted configuration Mitsunobu reaction used their was verified 2D-NOESY correlations, supported optimized structure employing DFT methods. An silico screening these compounds inhibitors SARS-CoV-2...
With the aim of producing new heterocycle molecules, previously reported 2-(aminomethyl)-2-(4-chlorophenyl)-2,3-dihydroquinazolin-4(1H)-one was converted efficiently by reacting with N,N′-dithiocarbonyldiimidazole (DTCI) to produce substituted imidazolidine-2-thione moiety inserted in a three-fused-ring scaffold title compound. The molecular composition confirmed high-resolution MS experiment, and its structure elucidated 1H, 13CNMR, IR analyses. thioacetamide form product supported density...