[5-(6-Bromo[1,2,4]Triazolo[4,3-A]Pyridin-3-Yl)-2,4-Dihydroxyphenyl](4-Methyl-1-Piperazinyl)Methanone

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Formula C18H18BrN5O3
IUPAC Name [5-(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-2,4-dihydroxy-phenyl]-(4-methylpiperazin-1-yl)methanone
Molecular Mass 432.271 g·mol−1
Heat of Formation 1889.1 ± 16.7 kJ·mol−1
Dipole Moment 4.94 ± 1.08 D
Volume 394.41 Å 3
Surface Area 349.07 Å 2
HOMO Energy -8.65 ± 0.55 eV
LUMO Energy -2.77 ± eV
Point Group Symmetry Cs
InChIKey MORDYVAZUXQMHB-UHFFFAOYSA-N
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Elements C Br O N