2'-Deoxy-2',2'-Difluoro-N-(2-Propylpentanoyl)Cytidine

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Formula C17H25F2N3O5
IUPAC Name n-[1-[(2r,4r,5r)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-oxo-pyrimidin-4-yl]-2-propyl-pentanamide
Molecular Mass 389.394 g·mol−1
Heat of Formation -1341.9 ± 16.7 kJ·mol−1
Dipole Moment 4.89 ± 1.08 D
Volume 449.85 Å 3
Surface Area 391.27 Å 2
HOMO Energy -9.68 ± 0.55 eV
LUMO Energy -0.88 ± eV
Point Group Symmetry C1
Synonyms
  • n-[1-[(2r,4r,5r)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-2-oxo-4-pyrimidinyl]-2-propylpentanamide
  • n-[1-[(2r,4r,5r)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxo-pyrimidin-4-yl]-2-propyl-pentanamide
  • n-[1-[(2r,4r,5r)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-oxo-pyrimidin-4-yl]-2-propyl-pentanamide
  • n-[1-[(2r,4r,5r)-3,3-difluoro-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]-2-keto-pyrimidin-4-yl]-2-propyl-valeramide
InChIKey MEOYFIHNRBNEPI-UXIGCNINSA-N
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