N-({(5S)-3-[4-(1,1-Dioxido-4-Thiomorpholinyl)-3,5-Difluorophenyl]-2-Oxo-1,3-Oxazolidin-5-Yl}Methyl)Acetamide

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Properties Simple | Detailed

Formula C16H19F2N3O5S
IUPAC Name n-[[(5s)-3-[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3,5-difluoro-phenyl]-2-oxo-oxazolidin-5-yl]methyl]acetamide
Molecular Mass 403.401 g·mol−1
Heat of Formation -1129.8 ± 16.7 kJ·mol−1
Dipole Moment 8.26 ± 1.08 D
Volume 427.87 Å 3
Surface Area 377.13 Å 2
HOMO Energy -9.57 ± 0.55 eV
LUMO Energy -0.92 ± eV
Point Group Symmetry C1
Synonyms
  • n-[[(5s)-3-[4-(1,1-diketo-1,4-thiazinan-4-yl)-3,5-difluoro-phenyl]-2-keto-oxazolidin-5-yl]methyl]acetamide
  • n-[[(5s)-3-[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3,5-difluoro-phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]ethanamide
  • n-[[(5s)-3-[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3,5-difluoro-phenyl]-2-oxo-oxazolidin-5-yl]methyl]acetamide
  • n-[[(5s)-3-[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3,5-difluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
  • n-[[(5s)-3-[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3,5-difluorophenyl]-2-oxo-5-oxazolidinyl]methyl]acetamide
InChIKey HSGZLFWXBIVLBD-LBPRGKRZSA-N
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