N-[(1R)-1-(4-Fluorophenyl)Ethyl]-N'-{(1S,2S)-1-Hydroxy-3-Phenyl-1-[(4S)-1,2,2-Trimethyl-5-Oxo-4-Imidazolidinyl]-2-Propanyl}-5-[Methyl(Methylsulfonyl)Amino]Isophthalamide

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Properties Simple | Detailed

Formula C33H40FN5O6S
IUPAC Name n1-[(1s,2s)-1-benzyl-2-hydroxy-2-[(4s)-1,2,2-trimethyl-5-oxo-imidazolidin-4-yl]ethyl]-n3-[(1r)-1-(4-fluorophenyl)ethyl]-5-[methyl(methylsulfonyl)amino]benzene-1,3-dicarboxamide
Molecular Mass 653.764 g·mol−1
Heat of Formation -1064.7 ± 16.7 kJ·mol−1
Dipole Moment 3.36 ± 1.08 D
Volume 786.65 Å 3
Surface Area 587.4 Å 2
HOMO Energy -9.59 ± 0.55 eV
LUMO Energy -1.13 ± eV
Point Group Symmetry C1
Synonyms
  • my9
  • n'-[(1s,2s)-1-(benzyl)-2-hydroxy-2-[(4s)-5-keto-1,2,2-trimethyl-imidazolidin-4-yl]ethyl]-n-[(1r)-1-(4-fluorophenyl)ethyl]-5-(mesyl-methyl-amino)isophthalamide
  • n-[(1r)-1-(4-fluorophenyl)ethyl]-n'-[(1s,2s)-1-hydroxy-3-phenyl-1-[(4s)-1,2,2-trimethyl-5-oxo-imidazolidin-4-yl]propan-2-yl]-5-(methyl-methylsulfonyl-amino)benzene-1,3-dicarboxamide
  • n-[(1r)-1-(4-fluorophenyl)ethyl]-n'-[(1s,2s)-1-hydroxy-3-phenyl-1-[(4s)-1,2,2-trimethyl-5-oxoimidazolidin-4-yl]propan-2-yl]-5-(methyl-methylsulfonylamino)benzene-1,3-dicarboxamide
  • n-[(1r)-1-(4-fluorophenyl)ethyl]-n'-[(1s,2s)-2-hydroxy-1-(phenylmethyl)-2-[(4s)-1,2,2-trimethyl-5-oxo-4-imidazolidinyl]ethyl]-5-(methyl-methylsulfonylamino)benzene-1,3-dicarboxamide
  • n-[(1r)-1-(4-fluorophenyl)ethyl]-n'-[(1s,2s)-2-hydroxy-1-(phenylmethyl)-2-[(4s)-1,2,2-trimethyl-5-oxo-imidazolidin-4-yl]ethyl]-5-(methyl-methylsulfonyl-amino)benzene-1,3-dicarboxamide
InChIKey YNXGIROKYOHHJW-UFAZYNLISA-N
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