Department of Chemistry, Faculty of Science, Tehran University, Tehran, I.R. IRAN
10.30492/ijcce.1999.10065
Abstract
Conformations and electronic properties of a series of imidazobenzodiazepines are investigated by AM1 semi-empirical quantum mechanics method. It is shown that substitution of Cl in position 7 instead of 8, changes the geometry of the seven membered lactam ring; this may put the N5 nitrogen in a better positon to act as a hydrogen bond acceptor, and the phenyl ring in position 6 is probably more adapted for hydrophobic pocket of the receptor binding site.
Rashidi Ranjbar,, P., Imanzadeh, G. H., Khorramabadi zar, A., & Najafpour, J. (1999). Structure-Activity Relationship of Imidazobenzodiazepines, an AM1 Semi-Empirical Quantum Mechanics Study. Iranian Journal of Chemistry and Chemical Engineering, 18(2), 79-82. doi: 10.30492/ijcce.1999.10065
MLA
Parviz Rashidi Ranjbar,; Gholam Hossein Imanzadeh; Ahmad Khorramabadi zar; Jamshid Najafpour. "Structure-Activity Relationship of Imidazobenzodiazepines, an AM1 Semi-Empirical Quantum Mechanics Study". Iranian Journal of Chemistry and Chemical Engineering, 18, 2, 1999, 79-82. doi: 10.30492/ijcce.1999.10065
HARVARD
Rashidi Ranjbar,, P., Imanzadeh, G. H., Khorramabadi zar, A., Najafpour, J. (1999). 'Structure-Activity Relationship of Imidazobenzodiazepines, an AM1 Semi-Empirical Quantum Mechanics Study', Iranian Journal of Chemistry and Chemical Engineering, 18(2), pp. 79-82. doi: 10.30492/ijcce.1999.10065
VANCOUVER
Rashidi Ranjbar,, P., Imanzadeh, G. H., Khorramabadi zar, A., Najafpour, J. Structure-Activity Relationship of Imidazobenzodiazepines, an AM1 Semi-Empirical Quantum Mechanics Study. Iranian Journal of Chemistry and Chemical Engineering, 1999; 18(2): 79-82. doi: 10.30492/ijcce.1999.10065
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