ChemSpider 2D Image | 5-{[1-(2-Hydroxyethyl)-4,5-dimethyl-3-oxido-1H-imidazol-2-yl](3,4,5-trimethoxyphenyl)methyl}-2,4,6(1H,3H,5H)-pyrimidinetrione | C21H26N4O8

5-{[1-(2-Hydroxyethyl)-4,5-dimethyl-3-oxido-1H-imidazol-2-yl](3,4,5-trimethoxyphenyl)methyl}-2,4,6(1H,3H,5H)-pyrimidinetrione

  • Molecular FormulaC21H26N4O8
  • Average mass462.453 Da
  • Monoisotopic mass462.175049 Da
  • ChemSpider ID58175698

More details:

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

2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-[[1-(2-hydroxyethyl)-4,5-dimethyl-3-oxido-1H-imidazol-2-yl](3,4,5-trimethoxyphenyl)methyl]- [ACD/Index Name]
5-{[1-(2-Hydroxyethyl)-4,5-dimethyl-3-oxido-1H-imidazol-2-yl](3,4,5-trimethoxyphenyl)methyl}-2,4,6(1H,3H,5H)-pyrimidinetrione [ACD/IUPAC Name]
5-{[1-(2-Hydroxyethyl)-4,5-dimethyl-3-oxido-1H-imidazol-2-yl](3,4,5-trimethoxyphenyl)methyl}-2,4,6(1H,3H,5H)-pyrimidintrion [German] [ACD/IUPAC Name]
5-{[1-(2-Hydroxyéthyl)-4,5-diméthyl-3-oxydo-1H-imidazol-2-yl](3,4,5-triméthoxyphényl)méthyl}-2,4,6(1H,3H,5H)-pyrimidinetrione [French] [ACD/IUPAC Name]
1-(2-hydroxyethyl)-4,5-dimethyl-2-((3,4,5-trimethoxyphenyl)(2,4,6-trioxohexahydropyrimidin-5-yl)methyl)-1H-imidazole 3-oxide

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.632
Molar Refractivity: 113.2±0.5 cm3
#H bond acceptors: 12
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: -1.76
ACD/LogD (pH 5.5): -1.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.07
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 154 Å2
Polarizability: 44.9±0.5 10-24cm3
Surface Tension: 53.2±7.0 dyne/cm
Molar Volume: 317.3±7.0 cm3

Click to predict properties on the Chemicalize site


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