2-Methyl-N-{4-Methyl-3-[(2-{[4-(4-Methyl-1-Piperazinyl)Phenyl]Amino}-5-Pyrimidinyl)Carbamoyl]Phenyl}-3-(Trifluoromethyl)Benzamide

Molecule SVG Image

Properties Simple | Detailed

Formula C32H32F3N7O2
IUPAC Name 2-methyl-n-[4-methyl-3-[[2-[4-(4-methylpiperazin-1-yl)anilino]pyrimidin-5-yl]carbamoyl]phenyl]-3-(trifluoromethyl)benzamide
Molecular Mass 603.637 g·mol−1
Heat of Formation -541.1 ± 16.7 kJ·mol−1
Dipole Moment 6.66 ± 1.08 D
Volume 685.65 Å 3
Surface Area 594.37 Å 2
HOMO Energy -7.94 ± 0.55 eV
LUMO Energy 1.88 ± eV
Point Group Symmetry C1
InChIKey YNJXLRWECIJSPA-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C F O N