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-Diethylacetamide

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Properties Simple | Detailed

Formula C24H20N8O2
IUPAC Name n,n-diethynyl-2-[[5-oxo-3-(penta-1,3-diynylamino)-4-(p-tolylmethylamino)pent-4-en-1-ynyl]amino]acetamide; molecular nitrogen
Molecular Mass 452.468 g·mol−1
Heat of Formation 3875.3 ± 16.7 kJ·mol−1
Dipole Moment 3.50 ± 1.08 D
Volume 497.45 Å 3
Surface Area 409.88 Å 2
HOMO Energy -8.72 ± 0.55 eV
LUMO Energy -2.43 ± 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-diethyl-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-diethyl-ethanamide
  • 2-[2-butyl-4-oxo-3-[[4-[2-(2h-tetrazol-5-yl)phenyl]phenyl]methyl]-5-imidazo[5,4-c]pyridinyl]-n,n-diethylacetamide
  • 2-[2-butyl-4-oxo-3-[[4-[2-(2h-tetrazol-5-yl)phenyl]phenyl]methyl]imidazo[5,4-c]pyridin-5-yl]-n,n-diethyl-acetamide
  • 2-butyl-4-oxo-4,5-dihydro-3-((2'-(1h-tetrazol-5-yl)-4-biphenylyl)methyl)-3h-imidazo(4,5-c)pyridine-5-(n,n-diethylacetamide)
  • 2botbmip
CAS Number(s)
  • 156222-09-2
InChIKey VDFOBEUYPXRSDL-UHFFFAOYSA-N
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