1-[2-(2-{[2-(Dimethylamino)Ethyl]Amino}-6-[2-(Isopropylamino)-1,3-Thiazol-5-Yl]-4-Pyrimidinyl)Benzyl]-3-Ethylurea

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Formula C24H34N8OS
IUPAC Name 1-[[2-[2-[2-(dimethylamino)ethylamino]-6-[2-(isopropylamino)thiazol-5-yl]pyrimidin-4-yl]phenyl]methyl]-3-ethyl-urea
Molecular Mass 482.645 g·mol−1
Heat of Formation 87.0 ± 16.7 kJ·mol−1
Dipole Moment 3.97 ± 1.08 D
Volume 593.32 Å 3
Surface Area 498.57 Å 2
HOMO Energy -8.36 ± 0.55 eV
LUMO Energy -0.68 ± eV
Point Group Symmetry C1
InChIKey JQWPDTBHOVYRPB-UHFFFAOYSA-N
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