ChemSpider 2D Image | N-[1-(beta-D-Arabinofuranosyl)-2-oxo-1,2-dihydro-4-pyrimidinyl]-L-asparagine | C13H18N4O8

N-[1-(β-D-Arabinofuranosyl)-2-oxo-1,2-dihydro-4-pyrimidinyl]-L-asparagine

  • Molecular FormulaC13H18N4O8
  • Average mass358.304 Da
  • Monoisotopic mass358.112457 Da
  • ChemSpider ID81368144

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

L-Asparagine, N-(1-β-D-arabinofuranosyl-1,2-dihydro-2-oxo-4-pyrimidinyl)- [ACD/Index Name]
N-[1-(β-D-Arabinofuranosyl)-2-oxo-1,2-dihydro-4-pyrimidinyl]-L-asparagin [German] [ACD/IUPAC Name]
N-[1-(β-D-Arabinofuranosyl)-2-oxo-1,2-dihydro-4-pyrimidinyl]-L-asparagine [ACD/IUPAC Name]
N-[1-(β-D-Arabinofuranosyl)-2-oxo-1,2-dihydro-4-pyrimidinyl]-L-asparagine [French] [ACD/IUPAC Name]
2098942-53-9 [RN]
Aspacytarabine

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

Density: 1.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.744
Molar Refractivity: 76.7±0.5 cm3
#H bond acceptors: 12
#H bond donors: 7
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: -1.90
ACD/LogD (pH 5.5): -5.26
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.36
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 195 Å2
Polarizability: 30.4±0.5 10-24cm3
Surface Tension: 92.0±7.0 dyne/cm
Molar Volume: 189.3±7.0 cm3

Click to predict properties on the Chemicalize site


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