Exploration of a library of triazolothiadiazole and triazolothiadiazine compounds as a highly potent and selective family of cholinesterase and monoamine oxidase inhibitors: Design, synthesis, X-ray diffraction analysis and molecular docking studies
Authors of publication
Iqbal, Jamshed; Khan, Imtiaz; Zaib, Sumera; Ibrar, Aliya; Abbas, Saba; Bakht, Mahwish; Hameed, Shahid; White, Jonathan M.; Rana, Usman Ali; Shahid, Mohammad
Journal of publication
RSC Adv.
Year of publication
2015
a
13.03 ± 0.0003 Å
b
17.3539 ± 0.0004 Å
c
8.6142 ± 0.0002 Å
α
90°
β
98.99 ± 0.002°
γ
90°
Cell volume
1923.93 ± 0.08 Å3
Cell temperature
130 ± 0.1 K
Ambient diffraction temperature
130 ± 2.1 K
Number of distinct elements
5
Space group number
14
Hermann-Mauguin space group symbol
P 1 21/c 1
Hall space group symbol
-P 2ybc
Residual factor for all reflections
0.0736
Residual factor for significantly intense reflections
0.0505
Weighted residual factors for significantly intense reflections
0.1156
Weighted residual factors for all reflections included in the refinement
0.1343
Goodness-of-fit parameter for all reflections included in the refinement
