(2R)-3,3-Dimethyl-1-{5-[4-(Trifluoromethyl)Phenyl]-1,3,4-Oxadiazol-2-Yl}-2-Butanyl {(3S)-1,2-Dioxo-1-[(2-Oxo-1,3-Oxazolidin-3-Yl)Amino]-3-Heptanyl}Carbamate

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Properties Simple | Detailed

Formula C26H32F3N5O7
IUPAC Name [(1r)-2,2-dimethyl-1-[[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]methyl]propyl] n-[(1s)-1-[2-oxo-2-[(2-oxooxazolidin-3-yl)amino]acetyl]pentyl]carbamate
Molecular Mass 583.557 g·mol−1
Heat of Formation -1622.6 ± 16.7 kJ·mol−1
Dipole Moment 3.44 ± 1.08 D
Volume 659.43 Å 3
Surface Area 484.73 Å 2
HOMO Energy -10.04 ± 0.55 eV
LUMO Energy 1.25 ± eV
Point Group Symmetry C1
Synonyms
  • (1r)-2,2-dimethyl-1-({5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl}methyl)propyl (1s)-1-{oxo[(2-oxo-1,3-oxazolidin-3-yl)amino]acetyl}pentylcarbamate
  • [(1r)-2,2-dimethyl-1-[[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]methyl]propyl] n-[(1s)-1-[2-oxo-2-[(2-oxooxazolidin-3-yl)amino]acetyl]pentyl]carbamate
  • [(2r)-3,3-dimethyl-1-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]butan-2-yl] n-[(3s)-1,2-dioxo-1-[(2-oxo-1,3-oxazolidin-3-yl)amino]heptan-3-yl]carbamate
  • n-[(1s)-1-[1,2-dioxo-2-[(2-oxo-3-oxazolidinyl)amino]ethyl]pentyl]carbamic acid [(1r)-2,2-dimethyl-1-[[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]methyl]propyl] ester
  • n-[(1s)-1-[2-keto-2-[(2-ketooxazolidin-3-yl)amino]acetyl]pentyl]carbamic acid [(1r)-2,2-dimethyl-1-[[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]methyl]propyl] ester
InChIKey IXXKXSFSQVTOKQ-ZWKOTPCHSA-N
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