ChemSpider 2D Image | 2-Deoxy-N-{5-[formyl(methyl)amino]-2-imino-6-oxo-1,2,3,6-tetrahydro-4-pyrimidinyl}-3-O-phosphono-beta-L-erythro-pentofuranosylamine | C11H18N5O8P

2-Deoxy-N-{5-[formyl(methyl)amino]-2-imino-6-oxo-1,2,3,6-tetrahydro-4-pyrimidinyl}-3-O-phosphono-β-L-erythro-pentofuranosylamine

  • Molecular FormulaC11H18N5O8P
  • Average mass379.263 Da
  • Monoisotopic mass379.089294 Da
  • ChemSpider ID68026603

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2-Deoxy-N-{5-[formyl(methyl)amino]-2-imino-6-oxo-1,2,3,6-tetrahydro-4-pyrimidinyl}-3-O-phosphono-β-L-erythro-pentofuranosylamine [ACD/IUPAC Name]
2-Desoxy-N-{5-[formyl(methyl)amino]-2-imino-6-oxo-1,2,3,6-tetrahydro-4-pyrimidinyl}-3-O-phosphono-β-L-erythro-pentofuranosylamin [German] [ACD/IUPAC Name]
2-Désoxy-N-{5-[formyl(méthyl)amino]-2-imino-6-oxo-1,2,3,6-tétrahydro-4-pyrimidinyl}-3-O-phosphono-β-L-érythro-pentofuranosylamine [French] [ACD/IUPAC Name]
β-L-erythro-Pentofuranosylamine, 2-deoxy-N-[5-(formylmethylamino)-1,2,3,6-tetrahydro-2-imino-6-oxo-4-pyrimidinyl]-, 3-(dihydrogen phosphate) [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 2.0±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.751
Molar Refractivity: 77.7±0.5 cm3
#H bond acceptors: 13
#H bond donors: 7
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: -4.54
ACD/LogD (pH 5.5): -7.79
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.81
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 203 Å2
Polarizability: 30.8±0.5 10-24cm3
Surface Tension: 102.9±7.0 dyne/cm
Molar Volume: 190.6±7.0 cm3

Click to predict properties on the Chemicalize site


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