2-({2-[(4-Carbamoylphenyl)Amino]-4-Pyrimidinyl}Amino)Benzamide

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Formula C18H16N6O2
IUPAC Name 2-[[2-(4-carbamoylanilino)pyrimidin-4-yl]amino]benzamide
Molecular Mass 348.359 g·mol−1
Heat of Formation 9.0 ± 16.7 kJ·mol−1
Dipole Moment 6.67 ± 1.08 D
Volume 392.53 Å 3
Surface Area 365.08 Å 2
HOMO Energy -8.80 ± 0.55 eV
LUMO Energy 2.10 ± eV
Point Group Symmetry C1
InChIKey DYZNHQCKJOEZRJ-UHFFFAOYSA-N
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