7-Amino-2-[3-Amino-4-(2-Hydroxy-3,4-Dimethoxyphenyl)-5-Methyl-6-Oxo-1,6-Dihydro-2-Pyridinyl]-6-Methoxy-5,8-Quinolinedione

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Properties Simple | Detailed

Formula C24H22N4O7
IUPAC Name 7-amino-2-[3-amino-4-(2-hydroxy-3,4-dimethoxy-phenyl)-5-methyl-6-oxo-1h-pyridin-2-yl]-6-methoxy-quinoline-5,8-dione
Molecular Mass 478.454 g·mol−1
Heat of Formation -674.2 ± 16.7 kJ·mol−1
Dipole Moment 4.00 ± 1.08 D
Volume 533.61 Å 3
Surface Area 452.81 Å 2
HOMO Energy -8.44 ± 0.55 eV
LUMO Energy -2.00 ± eV
Point Group Symmetry C1
Synonyms
  • 5,8-quinolinedione, 7-amino-2-(3-amino-1,6-dihydro-4-(2-hydroxy-3,4-dimethoxyphenyl)-5-methyl-6-oxo-2-pyridinyl)-6-methoxy-
  • 7-amino-2-[3-amino-4-(2-hydroxy-3,4-dimethoxy-phenyl)-5-methyl-6-oxo-1h-pyridin-2-yl]-6-methoxy-quinoline-5,8-dione
  • 7-amino-2-[3-amino-4-(2-hydroxy-3,4-dimethoxy-phenyl)-6-keto-5-methyl-1h-pyridin-2-yl]-6-methoxy-quinoline-5,8-quinone
  • 7-amino-2-[3-amino-4-(2-hydroxy-3,4-dimethoxyphenyl)-5-methyl-6-oxo-1h-pyridin-2-yl]-6-methoxyquinoline-5,8-dione
CAS Number(s)
  • 96684-38-7
InChIKey KDHCNBXWSJRGJW-UHFFFAOYSA-N
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