N-[5-(3-Pyridinyl)-1,3,4-Oxadiazol-2-Yl]-β-D-Glucopyranosylamine

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Properties Simple | Detailed

Formula C13H16N4O6
IUPAC Name (2r,3s,4s,5r,6r)-2-(hydroxymethyl)-6-[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]amino]tetrahydropyran-3,4,5-triol
Molecular Mass 324.289 g·mol−1
Heat of Formation -709.6 ± 16.7 kJ·mol−1
Dipole Moment 3.87 ± 1.08 D
Volume 352.67 Å 3
Surface Area 322.21 Å 2
HOMO Energy -9.63 ± 0.55 eV
LUMO Energy -1.37 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3s,4s,5r,6r)-2-(hydroxymethyl)-6-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)amino]oxane-3,4,5-triol
  • (2r,3s,4s,5r,6r)-2-(hydroxymethyl)-6-[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]amino]tetrahydropyran-3,4,5-triol
  • (2r,3s,4s,5r,6r)-2-methylol-6-[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]amino]tetrahydropyran-3,4,5-triol
  • 2-(n-d-glucosylamino)-5-(3-pyridyl)-1,3,4-oxadiazole
  • d-glucosylamine, n-(5-(3-pyridinyl)-1,3,4-oxadiazol-2-yl)-
CAS Number(s)
  • 51202-84-7
InChIKey LAISUNUJKLRARX-WSOSLHDDSA-N
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