5'-Deoxy-5-Fluoro-N-(3,4,5-Trimethoxybenzoyl)Cytidine

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Properties Simple | Detailed

Formula C19H22FN3O8
IUPAC Name n-[1-[(2r,3r,4s,5r)-3,4-dihydroxy-5-methyl-tetrahydrofuran-2-yl]-5-fluoro-2-oxo-pyrimidin-4-yl]-3,4,5-trimethoxy-benzamide
Molecular Mass 439.392 g·mol−1
Heat of Formation -1310.2 ± 16.7 kJ·mol−1
Dipole Moment 7.69 ± 1.08 D
Volume 472.56 Å 3
Surface Area 418.69 Å 2
HOMO Energy -9.12 ± 0.55 eV
LUMO Energy -0.93 ± eV
Point Group Symmetry C1
Synonyms
  • cytidine, 5'-deoxy-5-fluoro-n-(3,4,5-trimethoxybenzoyl)-
  • galocitabine
  • n-(1-(5-deoxy-beta-d-ribofuranosyl)-5-fluoro-1,2-dihydro-2-oxo-4-pyrimidinyl)-3,4,5-trimethoxybenzamide
  • n-[1-[(2r,3r,4s,5r)-3,4-dihydroxy-5-methyl-2-tetrahydrofuranyl]-5-fluoro-2-oxo-4-pyrimidinyl]-3,4,5-trimethoxybenzamide
  • n-[1-[(2r,3r,4s,5r)-3,4-dihydroxy-5-methyl-oxolan-2-yl]-5-fluoro-2-oxo-pyrimidin-4-yl]-3,4,5-trimethoxy-benzamide
  • n-[1-[(2r,3r,4s,5r)-3,4-dihydroxy-5-methyl-tetrahydrofuran-2-yl]-5-fluoro-2-keto-pyrimidin-4-yl]-3,4,5-trimethoxy-benzamide
  • n-[1-[(2r,3r,4s,5r)-3,4-dihydroxy-5-methyl-tetrahydrofuran-2-yl]-5-fluoro-2-oxo-pyrimidin-4-yl]-3,4,5-trimethoxy-benzamide
  • n-[1-[(2r,3r,4s,5r)-3,4-dihydroxy-5-methyloxolan-2-yl]-5-fluoro-2-oxopyrimidin-4-yl]-3,4,5-trimethoxybenzamide
  • ro 09-1390
  • ro-09-1390
CAS Number(s)
  • 124012-42-6
InChIKey TVYPSLDUBVTDIS-FUOMVGGVSA-N
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