N-[3-(Dimethylamino)Propyl]-4-[[4-(3-Fluoro-4-Methoxy-Phenyl)Pyrimidin-2-Yl]Amino]Benzenesulfonamide

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Formula C22H26FN5O3S
IUPAC Name n-[3-(dimethylamino)propyl]-4-[[4-(3-fluoro-4-methoxy-phenyl)pyrimidin-2-yl]amino]benzenesulfonamide
Molecular Mass 459.537 g·mol−1
Heat of Formation -356.0 ± 16.7 kJ·mol−1
Dipole Moment 4.87 ± 1.08 D
Volume 535.88 Å 3
Surface Area 407.35 Å 2
HOMO Energy -8.73 ± 0.55 eV
LUMO Energy 1.94 ± eV
Point Group Symmetry C1
InChIKey AXKXIEBMLJYNIC-UHFFFAOYSA-N
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