Nupafant

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Formula C23H32N4O3S
IUPAC Name n-[(1s)-1-(ethoxymethyl)-3-methyl-butyl]-n-methyl-4-[(2-methylimidazo[4,5-c]pyridin-1-ium-1-yl)methyl]benzenesulfonamide
Molecular Mass 444.590 g·mol−1
Heat of Formation -317.6 ± 16.7 kJ·mol−1
Dipole Moment 4.94 ± 1.08 D
Volume 558.61 Å 3
Surface Area 439.23 Å 2
HOMO Energy -9.19 ± 0.55 eV
LUMO Energy -0.94 ± eV
Point Group Symmetry C1
Synonyms
  • n-[(1s)-1-(ethoxymethyl)-3-methyl-butyl]-n-methyl-4-[(2-methylimidazo[4,5-c]pyridin-1-yl)methyl]benzenesulfonamide
  • n-[(1s)-1-(ethoxymethyl)-3-methylbutyl]-n-methyl-4-[(2-methyl-1-imidazo[4,5-c]pyridinyl)methyl]benzenesulfonamide
  • n-[(2s)-1-ethoxy-4-methyl-pentan-2-yl]-n-methyl-4-[(2-methylimidazo[4,5-c]pyridin-1-yl)methyl]benzenesulfonamide
  • n-[(2s)-1-ethoxy-4-methylpentan-2-yl]-n-methyl-4-[(2-methylimidazo[4,5-c]pyridin-1-yl)methyl]benzenesulfonamide
InChIKey GFUNPHNHBVCVHW-FQEVSTJZSA-N
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