ChemSpider 2D Image | 4-(Benzoylamino)-1-[2-deoxy-3-O-(1-hydroxyvinyl)-5-O-phosphonopentofuranosyl]-2(1H)-pyrimidinone | C18H20N3O9P

4-(Benzoylamino)-1-[2-deoxy-3-O-(1-hydroxyvinyl)-5-O-phosphonopentofuranosyl]-2(1H)-pyrimidinone

  • Molecular FormulaC18H20N3O9P
  • Average mass453.340 Da
  • Monoisotopic mass453.093719 Da
  • ChemSpider ID95641352

More details:

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

2(1H)-Pyrimidinone, 4-(benzoylamino)-1-[2-deoxy-3-O-(1-hydroxyethenyl)-5-O-phosphonopentofuranosyl]- [ACD/Index Name]
4-(Benzoylamino)-1-[2-deoxy-3-O-(1-hydroxyvinyl)-5-O-phosphonopentofuranosyl]-2(1H)-pyrimidinone [ACD/IUPAC Name]
4-(Benzoylamino)-1-[2-desoxy-3-O-(1-hydroxyvinyl)-5-O-phosphonopentofuranosyl]-2(1H)-pyrimidinon [German] [ACD/IUPAC Name]
4-(Benzoylamino)-1-[2-désoxy-3-O-(1-hydroxyvinyl)-5-O-phosphonopentofuranosyl]-2(1H)-pyrimidinone [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.665
Molar Refractivity: 103.9±0.5 cm3
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 0.00
ACD/LogD (pH 5.5): -5.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 177 Å2
Polarizability: 41.2±0.5 10-24cm3
Surface Tension: 72.2±7.0 dyne/cm
Molar Volume: 279.5±7.0 cm3

Click to predict properties on the Chemicalize site


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