6-(2-Cyclopropen-1-Ylmethoxy)-2-[6-(Cyclopropylmethyl)-5-Oxo-3,4,5,6-Tetrahydro-2,6-Naphthyridin-2(1H)-Yl]-7-Methoxy-4(3H)-Quinazolinone

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Properties Simple | Detailed

Formula C25H26N4O4++
IUPAC Name 6-(cycloprop-2-en-1-ylmethoxy)-2-[6-(cyclopropylmethyl)-5-oxo-3,4-dihydro-1h-2,6-naphthyridin-2-yl]-7-methoxy-quinazolin-3-ium-4-one
Molecular Mass 446.498 g·mol−1
Heat of Formation -52.4 ± 16.7 kJ·mol−1
Dipole Moment 3.27 ± 1.08 D
Volume 523.88 Å 3
Surface Area 461.4 Å 2
HOMO Energy -8.34 ± 0.55 eV
LUMO Energy 2.58 ± eV
Point Group Symmetry C1
InChIKey BVRCGDWCYYETOO-UHFFFAOYSA-N
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