5-[3-({4-[3-(4-Isopropylphenyl)-2-Pyrazinyl]-1-Piperazinyl}Sulfonyl)Phenyl]-2-Pyrimidinamine

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Formula C27H29N7O2S
IUPAC Name 5-[3-[4-[3-(4-isopropylphenyl)pyrazin-2-yl]piperazin-1-yl]sulfonylphenyl]pyrimidin-2-amine
Molecular Mass 515.630 g·mol−1
Heat of Formation 159.4 ± 16.7 kJ·mol−1
Dipole Moment 5.48 ± 1.08 D
Volume 604.78 Å 3
Surface Area 500.59 Å 2
HOMO Energy -8.63 ± 0.55 eV
LUMO Energy 2.16 ± eV
Point Group Symmetry C1
InChIKey IVXKQJAJTVBVLV-UHFFFAOYSA-N
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