2-(2-Butyl-4-Oxo-3-{[2'-(2H-Tetrazol-5-Yl)-4-Biphenylyl]Methyl}-3,4-Dihydro-5H-Imidazo[4,5-C]Pyridin-5-Yl)-N,N-Dimethylacetamide

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Properties Simple | Detailed

Formula C28H30N8O2
IUPAC Name 2-[2-butyl-4-oxo-3-[[4-[2-(2h-tetrazol-5-yl)phenyl]phenyl]methyl]imidazo[4,5-c]pyridin-5-yl]-n,n-dimethyl-acetamide
Molecular Mass 510.590 g·mol−1
Heat of Formation 231.6 ± 16.7 kJ·mol−1
Dipole Moment 6.26 ± 1.08 D
Volume 615.15 Å 3
Surface Area 475.58 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy -0.92 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[2-butyl-4-keto-3-[4-[2-(2h-tetrazol-5-yl)phenyl]benzyl]imidazo[5,4-c]pyridin-5-yl]-n,n-dimethyl-acetamide
  • 2-[2-butyl-4-oxo-3-[[4-[2-(2h-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]imidazo[5,4-c]pyridin-5-yl]-n,n-dimethyl-ethanamide
  • 2-[2-butyl-4-oxo-3-[[4-[2-(2h-tetrazol-5-yl)phenyl]phenyl]methyl]-5-imidazo[5,4-c]pyridinyl]-n,n-dimethylacetamide
  • 2-[2-butyl-4-oxo-3-[[4-[2-(2h-tetrazol-5-yl)phenyl]phenyl]methyl]imidazo[5,4-c]pyridin-5-yl]-n,n-dimethyl-acetamide
InChIKey CQVJTTOZTTVVBK-UHFFFAOYSA-N
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