Selexipag

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Formula C26H32N4O4S
IUPAC Name [2-[4-[[5,6-di(phenyl)pyrazine-1,4-diium-2-yl]-isopropyl-amino]butoxy]acetyl]-methylsulfonyl-azanide
Molecular Mass 496.622 g·mol−1
Heat of Formation -466.4 ± 16.7 kJ·mol−1
Dipole Moment 7.59 ± 1.08 D
Volume 595.84 Å 3
Surface Area 430.17 Å 2
HOMO Energy -8.67 ± 0.55 eV
LUMO Energy 2.37 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[4-[[5,6-di(phenyl)-2-pyrazinyl]-isopropylamino]butoxy]-n-methylsulfonylacetamide
  • 2-[4-[[5,6-di(phenyl)pyrazin-2-yl]-isopropyl-amino]butoxy]-n-mesyl-acetamide
  • 2-[4-[[5,6-di(phenyl)pyrazin-2-yl]-isopropyl-amino]butoxy]-n-methylsulfonyl-acetamide
  • 2-[4-[[5,6-di(phenyl)pyrazin-2-yl]-propan-2-yl-amino]butoxy]-n-methylsulfonyl-ethanamide
  • 2-[4-[[5,6-di(phenyl)pyrazin-2-yl]-propan-2-ylamino]butoxy]-n-methylsulfonylacetamide
InChIKey QXWZQTURMXZVHJ-UHFFFAOYSA-N
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