4-Methyl-3-[6-(4-Methyl-1-Piperazinyl)-4-Oxo-3(4H)-Quinazolinyl]-N-(1,2-Oxazol-3-Yl)Benzamide

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Properties Simple | Detailed

Formula C24H24N6O3+
IUPAC Name n-isoxazol-3-yl-4-methyl-3-[6-(4-methylpiperazin-1-yl)-4-oxo-quinazolin-3-yl]benzamide
Molecular Mass 444.486 g·mol−1
Heat of Formation 81.8 ± 16.7 kJ·mol−1
Dipole Moment 4.13 ± 1.08 D
Volume 513.23 Å 3
Surface Area 450.26 Å 2
HOMO Energy -8.40 ± 0.55 eV
LUMO Energy 2.14 ± eV
Point Group Symmetry C1
Synonyms
  • 4-methyl-3-[6-(4-methylpiperazin-1-yl)-4-oxo-quinazolin-3-yl]-n-(1,2-oxazol-3-yl)benzamide
  • n-(3-isoxazolyl)-4-methyl-3-[6-(4-methyl-1-piperazinyl)-4-oxo-3-quinazolinyl]benzamide
  • n-isoxazol-3-yl-3-[4-keto-6-(4-methylpiperazin-1-yl)quinazolin-3-yl]-4-methyl-benzamide
  • n-isoxazol-3-yl-4-methyl-3-[6-(4-methylpiperazin-1-yl)-4-oxo-quinazolin-3-yl]benzamide
InChIKey SWLHHASUIJPBPZ-UHFFFAOYSA-N
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