(5S)-3-(4-Acetylphenyl)-N-[(2S,3R)-3-Hydroxy-4-{Isobutyl[(4-Methoxyphenyl)Sulfonyl]Amino}-1-Phenyl-2-Butanyl]-2-Oxo-1,3-Oxazolidine-5-Carboxamide

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Properties Simple | Detailed

Formula C33H39N3O8S
IUPAC Name (5s)-3-(4-acetylphenyl)-n-[(1s,2r)-1-benzyl-2-hydroxy-3-[isobutyl-(4-methoxyphenyl)sulfonyl-amino]propyl]-2-oxo-oxazolidine-5-carboxamide
Molecular Mass 637.743 g·mol−1
Heat of Formation -1223.9 ± 16.7 kJ·mol−1
Dipole Moment 11.52 ± 1.08 D
Volume 744.03 Å 3
Surface Area 508.53 Å 2
HOMO Energy -9.37 ± 0.55 eV
LUMO Energy -0.95 ± eV
Point Group Symmetry C1
Synonyms
  • (5s)-3-(4-acetylphenyl)-n-[(1s,2r)-1-(benzyl)-2-hydroxy-3-[isobutyl-(4-methoxyphenyl)sulfonyl-amino]propyl]-2-keto-oxazolidine-5-carboxamide
  • (5s)-3-(4-acetylphenyl)-n-[(1s,2r)-2-hydroxy-3-[isobutyl-(4-methoxyphenyl)sulfonyl-amino]-1-(phenylmethyl)propyl]-2-oxo-oxazolidine-5-carboxamide
  • (5s)-3-(4-acetylphenyl)-n-[(1s,2r)-2-hydroxy-3-[isobutyl-(4-methoxyphenyl)sulfonylamino]-1-(phenylmethyl)propyl]-2-oxo-5-oxazolidinecarboxamide
  • (5s)-3-(4-acetylphenyl)-n-[(2s,3r)-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]-1-phenylbutan-2-yl]-2-oxo-1,3-oxazolidine-5-carboxamide
  • (5s)-3-(4-ethanoylphenyl)-n-[(2s,3r)-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]-1-phenyl-butan-2-yl]-2-oxo-1,3-oxazolidine-5-carboxamide
  • 5-oxazolidinecarboxamide, n-[(1s,2r)-2-hydroxy-3-[[(4-methoxyphenyl)sulfonyl](2-methylpropyl)amino]-1-(phenylmethyl)propyl]-2-oxo-3-(4-acetylphenyl)-, (5s)-
  • mui
InChIKey BUJKGFQFFGUYEM-YPKYBTACSA-N
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