5-Bromo-1-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-2,4(1H,3H)-pyrimidinedione | CAS No. 69123-97-3

5-Bromo-1-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-2,4(1H,3H)-pyrimidinedione

Basic Information

CAS Number

69123-97-3

Molecular Formula

C9H10BrFN2O5

Molecular Weight

325.09 g/mol

AD

Basic Physical Properties

Density

1.98±0.1 g/cm3 (20 ºC 760 Torr),

C1=C(C(=O)NC(=O)N1C2C(C(C(O2)CO)O)F)Br

InChI

InChI=1S/C9H10BrFN2O5/c10-3-1-13(9(17)12-7(3)16)8-5(11)6(15)4(2-14)18-8/h1,4-6,8,14-15H,2H2,(H,12,16,17)/t4-,5+,6-,8-/m1/s1

InChIKey

WFOXFPXBLFRFHB-BYPJNBLXSA-N

LogP

-1.1122000000000005

Topological Polar Surface Area

104.55000000000001 Ų

Hydrogen Bond Donor/Acceptor

3 / 7

Complexity

418

Synonyms & References

English

  • WFOXFPXBLFRFHB-BYPJNBLXSA-N
  • 5-Bromo-1-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-2,4(1H,3H)-pyrimidinedione
  • 5-bromo-1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione
  • 69123-97-3
  • CHEMBL3228492
  • SCHEMBL720545
  • 5-bromo-1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
  • 5-Bromo-1-((2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)-dione
  • 1-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-5-bromouracil
  • 2,4(1H,3H)-Pyrimidinedione,5-bromo-1-(2-deoxy-2-fluoro-b-D-arabinofuranosyl)-
  • 2,4(1H,3H)-Pyrimidinedione, 5-bromo-1-(2-deoxy-2-fluoro-β-D-arabinofuranosyl)-

MDL Number

MFCD22666306

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