Journal ArticleDOI
Novel dibenzosuberene substituted aroyl selenoureas: Synthesis, crystal structure, DFT, molecular docking and biological studies
TLDR
In vitro antibacterial action of aroyl selenourea dibenzosuberene derivatives was evaluated against chosen gram-negative and gram-positive bacteria for their antifungal activity and the binding modes were understood along with the mechanism in opposing the target protein MurB.Abstract:
A series of aroyl selenourea dibenzosuberene (1–3) derivatives were synthesized and characterized by different analytical methods and single crystal X-ray crystallography. Quantum chemical computat...read more
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Synthesis, characterization, in silico and in vitro biological activity studies of Ru(II) (η6-p-cymene) complexes with novel N-dibenzosuberene substituted aroyl selenourea exhibiting Se type coordination
TL;DR: A series of N-dibenzosuberene substituted aroyl selenourea ligands L1,L3 and their Ru(II) (η6-p-cymene) complexes 1-3 were synthesized and characterized by single-crystal XRD method as mentioned in this paper.
Journal ArticleDOI
One-Pot Four-Component Assembling for Selenoureas.
TL;DR: Thirty-three new structures of unsymmetrical selenoureas including three chiral examples and eight cycloselenouReas were achieved in one-pot with only the assistance of a base under mild conditions.
Journal ArticleDOI
Synthesis, characterization, theoretical, molecular docking and in vitro biological activity studies of Ru(II) (η6-p-cymene) complexes with novel aniline substituted aroyl selenoureas.
Moideen Musthafa,Ramaiah Konakanchi,Rakesh Ganguly,Chandrasekar Balachandran,Shin Aoki,Anandaram Sreekanth +5 more
TL;DR: The docking results strongly support the protein binding studies of the complexes and the single-crystal XRD study showed that aroyl selenourea ligand coordinates with Ru via Se novel neutral monodentate atom.
Journal ArticleDOI
Experimental and computational structural studies of 5-substituted-3-(1-arylmethyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indoles
Agata Bartyzel,Magda Kondej,Piotr Stępnicki,Tomasz M. Wróbel,Agnieszka A. Kaczor,Agnieszka A. Kaczor +5 more
TL;DR: In this paper, the X-ray analysis conducted for studied compounds proved that interatomic distances and bond angles in their crystal structures lie within normal values, and the most reactive parts of the compounds appear to be the indole and double bond located in tetrahydropyridine moiety.
Journal ArticleDOI
Sol-gel silica doped with 3-(2-naphthoyl)-1,1-dibutylselenourea, an efficient precursor for removal of Pb(II) and Zn(II) from water samples
Rana Farhat Mehmood,Sher Ali Khan,Ezzat Khan,Muhammad Izhar,Ayesha Samee,Muhammad Saeed Akhter +5 more
TL;DR: In this article , the porosity study reveals that the doped sol-gel contains pores which are responsible for the adsorption of metal ions, besides pores present in the material, the ligand possesses active sites (NH, = O, = Se) readily available for coordination with metal ions.
References
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Journal ArticleDOI
Synthesis, crystal structure, DFT study, in vitro and in silico molecular docking of novel bis (aroyl selenourea) derivatives
Moideen Musthafa,K.N. Aneesrahman,Balaji Perumalsamy,Thirumurugan Ramasamy,Rakesh Ganguly,Anandaram Sreekanth +5 more
TL;DR: A new family of o-phenylenediamine substituted bis (aroyl selenourea) 1−3 were synthesised and characterised by spectroscopic methods and single crystal XRD studies as discussed by the authors.
Journal ArticleDOI
Design, Synthesis, Neuroprotective and Antibacterial Activities of 1,2,4-Triazolo[3,4-b]1,3,4-thiadiazole Linked Thieno[2,3-d]pyrimidine Derivatives and In Silico Docking Studies
Triloknadh Settypalli,Venkata Rao Chunduri,Nagaraju Kerru,Hari Krishna Nallapaneni,Venkata Ramaiah Chintha,Trinath Daggupati,Suneetha Yeguvapalli,Rajendra Wudayagiri +7 more
Journal ArticleDOI
Synthesis and structural studies of some selenoureas and their metal complexes
TL;DR: The selenoureas PhC(O)NHC(Se)NPhMe, 4-MeC6H4C (O)NC(SE)NEt2}(Bu2bipy) as discussed by the authors was prepared and characterized by spectroscopic methods and single crystal X-ray diffraction.
Journal ArticleDOI
Therapeutic Drug Monitoring and Methods of Quantitation for Carbamazepine
Cristian Tuchila,Daniela Luiza Baconi,Cristina Dinu Pirvu,Denisa Oana Balalau,Ana Maria Vlasceanu,Miriana Stan,Cristian Balalau +6 more
Journal ArticleDOI
On the syntheses of dibenzosuberenone and 2,8-dimethyl-dibenzosuberenone
TL;DR: In this paper, an alternative method for the preparation of 2,8dimethyldibenzosuberenone involving radical bromination with 2,2'-azo-bis-isobutyronitrile (AIBN) and dehydrohalogenation under basic conditions was applied to obtain the target compound.