Antiproliferative Activity of New Derivatives of Pyrazino[1,2-A]Benzimidazole: Integrated Cell-Based Assay and Computational Studies With Divalent Magnesium, Iron, and Copper Ions

Antiproliferative Activity of New Derivatives of Pyrazino[1,2-A]Benzimidazole: Integrated Cell-Based Assay and Computational Studies With Divalent Magnesium, Iron, and Copper Ions Publisher Pubmed

Rahimifard M¹ ; Jalalimanesh N² ; Movahed MA³ ; Hadjighassem M^{4, 5} ; Pourahmad Jaktaji R⁶ ; Bagheri Z⁷ ; Pourahmad J⁸ ; Zarghi A³

Show Affiliations

1. Pharmaceutical Sciences Research Center, Shahid Beheshti University of Medical Sciences, Tehran, Iran
2. School of Chemistry, College of Science, University of Tehran, Tehran, Iran
3. Department of Medicinal and Pharmaceutical Chemistry, Shahid Beheshti University of Medical Sciences, Tehran, Iran
4. Brain and Spinal Cord Injury Research Center, Neuroscience Institute, Tehran University of Medical Sciences, Tehran, Iran
5. Department of Neuroscience and Addiction Studies, School of Advanced Technologies in Medicine, Tehran University of Medical Sciences, Tehran, Iran
6. Department of Genetics, Faculty of Sciences, Shahrekord University, Shahrekord, Iran
7. Faculty of Life Sciences and Biotechnology, Shahid Beheshti University G.C., Tehran, Iran
8. Department of Toxicology and Pharmacology, Faculty of Pharmacy, Shahid Beheshti University of Medical Sciences, Tehran, Iran

Source: Journal of Biochemical and Molecular Toxicology Published:2022

Abstract

Magnesium, iron, and copper are three vital metals that play essential roles in cancer cell proliferation. This study aimed to evaluate the metal chelation of new derivatives of pyrazino[1,2-a]benzimidazole and investigate their antiproliferative properties. The density functional theory method has been employed to evaluate the complexation properties of new synthetic pyrazino[1,2-a]benzimidazole derivatives possessing the 4-OMe, 2,4-dimethyl, and 3,4,5-trimethoxy substitution on N-2 phenyl ring with divalent magnesium, iron, and copper. The free energies for the water-ligand exchange reactions were employed to investigate the thermodynamic stability, water exchange properties, and electronic properties in the gas phase. Natural population analysis was employed to estimate atomic partial charges, second-order interactions between the filled and vacant orbitals, and the occupancies of the metals' valence s, p, and d orbitals. Among pyrazino[1,2-a]benzimidazole derivatives, the 3,4,5-trimethoxy substituted pyrazino[1,2-a]benzimidazole shows better electron donor ability. This compound also reduced proliferation and increased the apoptosis of human glioblastoma cancer cells. © 2022 Wiley Periodicals LLC.

Style	Citing Format
MLA	Rahimifard M, et al.. "Antiproliferative Activity of New Derivatives of Pyrazino[1,2-A]Benzimidazole: Integrated Cell-Based Assay and Computational Studies With Divalent Magnesium, Iron, and Copper Ions." Journal of Biochemical and Molecular Toxicology, vol. 36, no. 10, 2022, pp. -.
APA	Rahimifard M, Jalalimanesh N, Movahed MA, Hadjighassem M, Pourahmad Jaktaji R, Bagheri Z, Pourahmad J, Zarghi A (2022). Antiproliferative Activity of New Derivatives of Pyrazino[1,2-A]Benzimidazole: Integrated Cell-Based Assay and Computational Studies With Divalent Magnesium, Iron, and Copper Ions. Journal of Biochemical and Molecular Toxicology, 36(10), -.
Chicago	Rahimifard M, Jalalimanesh N, Movahed MA, Hadjighassem M, Pourahmad Jaktaji R, Bagheri Z, Pourahmad J, Zarghi A. "Antiproliferative Activity of New Derivatives of Pyrazino[1,2-A]Benzimidazole: Integrated Cell-Based Assay and Computational Studies With Divalent Magnesium, Iron, and Copper Ions." Journal of Biochemical and Molecular Toxicology 36, no. 10 (2022): -.
Harvard	Rahimifard M et al. (2022) 'Antiproliferative Activity of New Derivatives of Pyrazino[1,2-A]Benzimidazole: Integrated Cell-Based Assay and Computational Studies With Divalent Magnesium, Iron, and Copper Ions', Journal of Biochemical and Molecular Toxicology, 36(10), pp. -.
Vancouver	Rahimifard M, Jalalimanesh N, Movahed MA, Hadjighassem M, Pourahmad Jaktaji R, Bagheri Z, et al.. Antiproliferative Activity of New Derivatives of Pyrazino[1,2-A]Benzimidazole: Integrated Cell-Based Assay and Computational Studies With Divalent Magnesium, Iron, and Copper Ions. Journal of Biochemical and Molecular Toxicology. 2022;36(10):-.
BibTex	@article{ author = {Rahimifard M and Jalalimanesh N and Movahed MA and Hadjighassem M and Pourahmad Jaktaji R and Bagheri Z and Pourahmad J and Zarghi A}, title = {Antiproliferative Activity of New Derivatives of Pyrazino[1,2-A]Benzimidazole: Integrated Cell-Based Assay and Computational Studies With Divalent Magnesium, Iron, and Copper Ions}, journal = {Journal of Biochemical and Molecular Toxicology}, volume = {36}, number = {10}, pages = {-}, year = {2022} }
RIS	TY - JOUR AU - Rahimifard M AU - Jalalimanesh N AU - Movahed MA AU - Hadjighassem M AU - Pourahmad Jaktaji R AU - Bagheri Z AU - Pourahmad J AU - Zarghi A TI - Antiproliferative Activity of New Derivatives of Pyrazino[1,2-A]Benzimidazole: Integrated Cell-Based Assay and Computational Studies With Divalent Magnesium, Iron, and Copper Ions JO - Journal of Biochemical and Molecular Toxicology VL - 36 IS - 10 SP - EP - PY - 2022 ER -

Style

Citing Format

MLA

Rahimifard M, et al.. "Antiproliferative Activity of New Derivatives of Pyrazino[1,2-A]Benzimidazole: Integrated Cell-Based Assay and Computational Studies With Divalent Magnesium, Iron, and Copper Ions." Journal of Biochemical and Molecular Toxicology, vol. 36, no. 10, 2022, pp. -.

APA

Rahimifard M, Jalalimanesh N, Movahed MA, Hadjighassem M, Pourahmad Jaktaji R, Bagheri Z, Pourahmad J, Zarghi A (2022). Antiproliferative Activity of New Derivatives of Pyrazino[1,2-A]Benzimidazole: Integrated Cell-Based Assay and Computational Studies With Divalent Magnesium, Iron, and Copper Ions. Journal of Biochemical and Molecular Toxicology, 36(10), -.

Chicago

Rahimifard M, Jalalimanesh N, Movahed MA, Hadjighassem M, Pourahmad Jaktaji R, Bagheri Z, Pourahmad J, Zarghi A. "Antiproliferative Activity of New Derivatives of Pyrazino[1,2-A]Benzimidazole: Integrated Cell-Based Assay and Computational Studies With Divalent Magnesium, Iron, and Copper Ions." Journal of Biochemical and Molecular Toxicology 36, no. 10 (2022): -.

Harvard

Rahimifard M et al. (2022) 'Antiproliferative Activity of New Derivatives of Pyrazino[1,2-A]Benzimidazole: Integrated Cell-Based Assay and Computational Studies With Divalent Magnesium, Iron, and Copper Ions', Journal of Biochemical and Molecular Toxicology, 36(10), pp. -.

Vancouver

Rahimifard M, Jalalimanesh N, Movahed MA, Hadjighassem M, Pourahmad Jaktaji R, Bagheri Z, et al.. Antiproliferative Activity of New Derivatives of Pyrazino[1,2-A]Benzimidazole: Integrated Cell-Based Assay and Computational Studies With Divalent Magnesium, Iron, and Copper Ions. Journal of Biochemical and Molecular Toxicology. 2022;36(10):-.

BibTex

@article{ author = {Rahimifard M and Jalalimanesh N and Movahed MA and Hadjighassem M and Pourahmad Jaktaji R and Bagheri Z and Pourahmad J and Zarghi A}, title = {Antiproliferative Activity of New Derivatives of Pyrazino[1,2-A]Benzimidazole: Integrated Cell-Based Assay and Computational Studies With Divalent Magnesium, Iron, and Copper Ions}, journal = {Journal of Biochemical and Molecular Toxicology}, volume = {36}, number = {10}, pages = {-}, year = {2022} }

RIS

TY - JOUR
AU - Rahimifard M
AU - Jalalimanesh N
AU - Movahed MA
AU - Hadjighassem M
AU - Pourahmad Jaktaji R
AU - Bagheri Z
AU - Pourahmad J
AU - Zarghi A
TI - Antiproliferative Activity of New Derivatives of Pyrazino[1,2-A]Benzimidazole: Integrated Cell-Based Assay and Computational Studies With Divalent Magnesium, Iron, and Copper Ions
JO - Journal of Biochemical and Molecular Toxicology
VL - 36
IS - 10
SP -
EP -
PY - 2022
ER -

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