1-(Aminomethyl)-N-(3-{[6-Bromo-2-(4-Methoxyphenyl)-1H-Imidazo[4,5-B]Pyridin-7-Yl]Amino}Propyl)Cyclopropanecarboxamide

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Properties Simple | Detailed

Formula C21H25BrN6O2
IUPAC Name 1-(aminomethyl)-n-[3-[[6-bromo-2-(4-methoxyphenyl)imidazo[4,5-b]pyridin-3-ium-7-yl]amino]propyl]cyclopropanecarboxamide
Molecular Mass 473.366 g·mol−1
Heat of Formation 67.6 ± 16.7 kJ·mol−1
Dipole Moment 2.97 ± 1.08 D
Volume 511.37 Å 3
Surface Area 448.38 Å 2
HOMO Energy -8.49 ± 0.55 eV
LUMO Energy 2.35 ± eV
Point Group Symmetry C1
InChIKey XUELBKVSGYWSKD-UHFFFAOYSA-N
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Elements H C Br O N