N-{4-Methyl-3-[6-(4-Methyl-1-Piperazinyl)-4-Oxo-3(4H)-Quinazolinyl]Phenyl}-3-Furamide

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Properties Simple | Detailed

Formula C25H25N5O3
IUPAC Name n-[4-methyl-3-[6-(4-methylpiperazin-1-yl)-4-oxo-quinazolin-3-yl]phenyl]furan-3-carboxamide
Molecular Mass 443.498 g·mol−1
Heat of Formation -41.0 ± 16.7 kJ·mol−1
Dipole Moment 3.40 ± 1.08 D
Volume 517.17 Å 3
Surface Area 452.55 Å 2
HOMO Energy -8.20 ± 0.55 eV
LUMO Energy -0.86 ± eV
Point Group Symmetry C1
InChIKey NJOPZZLYRDEEQE-UHFFFAOYSA-N
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