N-{3-[(3-{4-[(4-Methoxyphenyl)Amino]-1,3,5-Triazin-2-Yl}-2-Pyridinyl)Amino]-4-Methylphenyl}-4-[(4-Methyl-1-Piperazinyl)Methyl]Benzamide

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Properties Simple | Detailed

Formula C35H37N9O2
IUPAC Name n-[3-[[3-[4-(4-methoxyanilino)-1,3,5-triazin-2-yl]-2-pyridyl]amino]-4-methyl-phenyl]-4-[(4-methylpiperazin-1-yl)methyl]benzamide
Molecular Mass 615.727 g·mol−1
Heat of Formation 310.6 ± 16.7 kJ·mol−1
Dipole Moment 4.39 ± 1.08 D
Volume 739.08 Å 3
Surface Area 637.74 Å 2
HOMO Energy -8.23 ± 0.55 eV
LUMO Energy 2.02 ± eV
Point Group Symmetry C1
InChIKey GYWHBDTXHKFFLF-UHFFFAOYSA-N
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