N-{4-[(2-Amino-6-Methyl-4-Pyrimidinyl)Amino]Phenyl}-4-(4-Quinolinylamino)Benzamide

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Properties Simple | Detailed

Formula C27H23N7O
IUPAC Name n-[4-[(2-amino-6-methyl-pyrimidin-4-yl)amino]phenyl]-4-(4-quinolylamino)benzamide
Molecular Mass 461.518 g·mol−1
Heat of Formation 376.2 ± 16.7 kJ·mol−1
Dipole Moment 2.43 ± 1.08 D
Volume 532.14 Å 3
Surface Area 484.4 Å 2
HOMO Energy -8.25 ± 0.55 eV
LUMO Energy -1.39 ± eV
Point Group Symmetry C1
InChIKey QSYLKMKIVWJAAK-UHFFFAOYSA-N
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