N-(2-Methyl-5-{[2-(4-Morpholinyl)Isonicotinoyl]Amino}Phenyl)-6-({2-[(2S)-1-Methyl-2-Pyrrolidinyl]Ethyl}Amino)Nicotinamide

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Properties Simple | Detailed

Formula C30H37N7O3
IUPAC Name n-[2-methyl-5-[(2-morpholinopyridine-4-carbonyl)amino]phenyl]-6-[2-[(2s)-1-methylpyrrolidin-2-yl]ethylamino]pyridine-3-carboxamide
Molecular Mass 543.660 g·mol−1
Heat of Formation -187.7 ± 16.7 kJ·mol−1
Dipole Moment 9.84 ± 1.08 D
Volume 660.23 Å 3
Surface Area 580.59 Å 2
HOMO Energy -8.36 ± 0.55 eV
LUMO Energy -0.71 ± eV
Point Group Symmetry C1
InChIKey DVPVWRYIDHDOOO-VWLOTQADSA-N
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