6-Ethyl-5-Iodo-2-{5-[(4-Methyl-1-Piperazinyl)Sulfonyl]-2-Propoxyphenyl}-4(1H)-Pyrimidinone

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Formula C20H27IN4O4S
IUPAC Name 6-ethyl-5-iodo-2-[5-(4-methylpiperazin-1-yl)sulfonyl-2-propoxy-phenyl]-1h-pyrimidin-4-one
Molecular Mass 546.422 g·mol−1
Heat of Formation -447.2 ± 16.7 kJ·mol−1
Dipole Moment 9.37 ± 1.08 D
Volume 541.26 Å 3
Surface Area 441.82 Å 2
HOMO Energy -8.51 ± 0.55 eV
LUMO Energy -1.31 ± eV
Point Group Symmetry C1
InChIKey CLYYLXSJJMHCHN-UHFFFAOYSA-N
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