(4-{5-Amino-6-[(2,6-Dichlorobenzyl)Amino]-2-Pyrazinyl}Phenyl)[(2R)-2-(1-Pyrrolidinylmethyl)-1-Pyrrolidinyl]Methanone

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Formula C27H30Cl2N6O
IUPAC Name [4-[5-amino-6-[(2,6-dichlorophenyl)methylamino]pyrazin-2-yl]phenyl]-[(2r)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methanone
Molecular Mass 525.473 g·mol−1
Heat of Formation 89.1 ± 16.7 kJ·mol−1
Dipole Moment 5.65 ± 1.08 D
Volume 609.38 Å 3
Surface Area 476.67 Å 2
HOMO Energy -8.45 ± 0.55 eV
LUMO Energy 2.30 ± eV
Point Group Symmetry C1
InChIKey PVBCEWZVPUKFNT-HXUWFJFHSA-N
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