6-(2,4-Difluorophenoxy)-8-Methyl-2-{[(2R)-1-(Methylsulfonyl)-2-Propanyl]Amino}Pyrido[2,3-D]Pyrimidin-7(8H)-One

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Formula C18H18F2N4O4S
IUPAC Name 6-(2,4-difluorophenoxy)-8-methyl-2-[[(1r)-1-methyl-2-methylsulfonyl-ethyl]amino]pyrido[2,3-d]pyrimidin-7-one
Molecular Mass 424.422 g·mol−1
Heat of Formation -759.4 ± 16.7 kJ·mol−1
Dipole Moment 12.34 ± 1.08 D
Volume 454.21 Å 3
Surface Area 402.46 Å 2
HOMO Energy -8.85 ± 0.55 eV
LUMO Energy -1.29 ± eV
Point Group Symmetry C1
InChIKey DVEYHFXOGUYFBU-SNVBAGLBSA-N
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