2-(4-{6-Chloro-2-[4-(Dimethylamino)Phenyl]-1H-Imidazo[4,5-B]Pyridin-7-Yl}-1-Piperazinyl)-N-(1,3-Thiazol-2-Yl)Acetamide

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Properties Simple | Detailed

Formula C23H25ClN8OS
IUPAC Name 2-[4-[6-chloro-2-[4-(dimethylamino)phenyl]-1h-imidazo[4,5-b]pyridine-3,4-diium-6-id-7-yl]piperazin-1-yl]-n-(4h-thiazol-1-ium-4-ylium-2-yl)acetamide
Molecular Mass 497.016 g·mol−1
Heat of Formation 428.7 ± 16.7 kJ·mol−1
Dipole Moment 6.94 ± 1.08 D
Volume 567.45 Å 3
Surface Area 489.18 Å 2
HOMO Energy -8.33 ± 0.55 eV
LUMO Energy -0.91 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[4-[6-chloro-2-(4-dimethylaminophenyl)-1h-imidazo[4,5-b]pyridin-7-yl]-1-piperazinyl]-n-(2-thiazolyl)acetamide
  • 2-[4-[6-chloro-2-(4-dimethylaminophenyl)-1h-imidazo[4,5-b]pyridin-7-yl]piperazin-1-yl]-n-(1,3-thiazol-2-yl)acetamide
  • 2-[4-[6-chloro-2-(4-dimethylaminophenyl)-1h-imidazo[4,5-b]pyridin-7-yl]piperazin-1-yl]-n-(1,3-thiazol-2-yl)ethanamide
  • 2-[4-[6-chloro-2-(4-dimethylaminophenyl)-1h-imidazo[4,5-b]pyridin-7-yl]piperazin-1-yl]-n-thiazol-2-yl-acetamide
InChIKey QYKHWEFPFAGNEV-UHFFFAOYSA-N
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