[4-(4-Amino-6,7-Dimethoxy-2-Quinazolinyl)-1-Piperazinyl](7-Hydroxy-2,3-Dihydro-1,4-Benzodioxin-2-Yl)Methanone

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Properties Simple | Detailed

Formula C23H26N5O6
IUPAC Name (3s)-3-[4-(4-λ1-azanyl-7,8-dihydro-6h-quinazoline-1,3-diium-6,7,8-triid-2-yl)piperazine-1-carbonyl]-2,3-dihydrobenzo[b][1,4]dioxin-6-one; methanone
Molecular Mass 468.482 g·mol−1
Heat of Formation 961.6 ± 16.7 kJ·mol−1
Dipole Moment 6.27 ± 1.08 D
Volume 532.61 Å 3
Surface Area 472.54 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy -3.66 ± eV
Point Group Symmetry C1
InChIKey CAWNIHKSMVDTKO-FQEVSTJZSA-N
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