N-[1,3-Di(4-Morpholinyl)-2-Propanyl]-3-(α-D-Galactopyranosyloxy)-5-Nitrobenzamide

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Properties Simple | Detailed

Formula C24H36N4O11
IUPAC Name n-[2-morpholino-1-(morpholinomethyl)ethyl]-3-nitro-5-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-benzamide
Molecular Mass 556.563 g·mol−1
Heat of Formation -1516.4 ± 16.7 kJ·mol−1
Dipole Moment 1.39 ± 1.08 D
Volume 643.9 Å 3
Surface Area 511.89 Å 2
HOMO Energy -9.14 ± 0.55 eV
LUMO Energy -1.62 ± eV
Point Group Symmetry C1
Synonyms
  • 1dm
  • n-(2-morpholin-4-yl-1-morpholin-4-ylmethyl-ethyl)-3-nitro-5-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-benzamide
  • n-[1,3-di(morpholin-4-yl)propan-2-yl]-3-nitro-5-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-benzamide
  • n-[2-morpholino-1-(morpholinomethyl)ethyl]-3-nitro-5-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-benzamide
  • n-[2-morpholino-1-(morpholinomethyl)ethyl]-3-nitro-5-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-benzamide
  • n-[2-morpholino-1-(morpholinomethyl)ethyl]-3-nitro-5-[[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]benzamide
InChIKey MCMWCTMAKPQTPI-WGNYYXNJSA-N
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