2-Amino-5-{4-[(4-Methyl-1-Piperazinyl)Sulfonyl]Phenyl}-N-[4-(1-Pyrrolidinylmethyl)-3-Pyridinyl]Nicotinamide

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Formula C27H33N7O3S
IUPAC Name 2-amino-5-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-n-[4-(pyrrolidin-1-ylmethyl)-3-pyridyl]pyridine-3-carboxamide
Molecular Mass 535.661 g·mol−1
Heat of Formation -166.8 ± 16.7 kJ·mol−1
Dipole Moment 2.48 ± 1.08 D
Volume 633.56 Å 3
Surface Area 512.74 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy 2.12 ± eV
Point Group Symmetry C1
InChIKey CWMNDXXSBKRROR-UHFFFAOYSA-N
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