N-[(1S)-1-(5-Fluoro-2-Methoxyphenyl)Ethyl]-2-{4-[(5-Isobutyl-2-Pyrimidinyl)Sulfamoyl]Phenyl}Acetamide

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Formula C25H29FN4O4S
IUPAC Name n-[(1s)-1-(5-fluoro-2-methoxy-phenyl)ethyl]-2-[4-[(5-isobutylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide
Molecular Mass 500.586 g·mol−1
Heat of Formation -664.5 ± 16.7 kJ·mol−1
Dipole Moment 6.89 ± 1.08 D
Volume 591.16 Å 3
Surface Area 501.44 Å 2
HOMO Energy -9.14 ± 0.55 eV
LUMO Energy 2.41 ± eV
Point Group Symmetry C1
Synonyms
  • n-[(1s)-1-(5-fluoro-2-methoxy-phenyl)ethyl]-2-[4-[[5-(2-methylpropyl)pyrimidin-2-yl]sulfamoyl]phenyl]ethanamide
  • n-[(1s)-1-(5-fluoro-2-methoxyphenyl)ethyl]-2-[4-[[5-(2-methylpropyl)pyrimidin-2-yl]sulfamoyl]phenyl]acetamide
  • sh-31168
InChIKey CKOLETHYECDWSS-KRWDZBQOSA-N
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