2-Methyl-2-Propanyl 6-{[2-Chloro-4-(1-Methyl-1H-Imidazol-5-Yl)Phenyl]Amino}-2-(1-Methyl-1H-Pyrazol-4-Yl)-1H-Pyrrolo[3,2-C]Pyridine-1-Carboxylate

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Properties Simple | Detailed

Formula C26H26ClN7O2
IUPAC Name tert-butyl 6-[2-chloro-4-(3-methylimidazol-4-yl)anilino]-2-(1-methylpyrazol-4-yl)pyrrolo[3,2-c]pyridine-1-carboxylate
Molecular Mass 503.983 g·mol−1
Heat of Formation 172.3 ± 16.7 kJ·mol−1
Dipole Moment 7.60 ± 1.08 D
Volume 581.82 Å 3
Surface Area 502.06 Å 2
HOMO Energy -8.12 ± 0.55 eV
LUMO Energy 2.28 ± eV
Point Group Symmetry C1
InChIKey BXKNUXDLZJPPBO-UHFFFAOYSA-N
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Elements H C Cl O N