ChemSpider 2D Image | 5-{[7-(2-Hydroxypropyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]hydrazono}-1,3-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione | C15H18N8O6

5-{[7-(2-Hydroxypropyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]hydrazono}-1,3-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione

  • Molecular FormulaC15H18N8O6
  • Average mass406.353 Da
  • Monoisotopic mass406.134918 Da
  • ChemSpider ID59754666

More details:

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

2,4,5,6(1H,3H)-Pyrimidinetetrone, 1,3-dimethyl-, 5-[2-[2,3,6,7-tetrahydro-7-(2-hydroxypropyl)-3-methyl-2,6-dioxo-1H-purin-8-yl]hydrazone] [ACD/Index Name]
5-{[7-(2-Hydroxypropyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]hydrazono}-1,3-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione [ACD/IUPAC Name]
5-{[7-(2-Hydroxypropyl)-3-méthyl-2,6-dioxo-2,3,6,7-tétrahydro-1H-purin-8-yl]hydrazono}-1,3-diméthyl-2,4,6(1H,3H,5H)-pyrimidinetrione [French] [ACD/IUPAC Name]
5-{[7-(2-Hydroxypropyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]hydrazono}-1,3-dimethyl-2,4,6(1H,3H,5H)-pyrimidintrion [German] [ACD/IUPAC Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.777
Molar Refractivity: 96.4±0.5 cm3
#H bond acceptors: 14
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -3.09
ACD/LogD (pH 5.5): -2.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.11
ACD/LogD (pH 7.4): -3.44
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 170 Å2
Polarizability: 38.2±0.5 10-24cm3
Surface Tension: 79.5±7.0 dyne/cm
Molar Volume: 230.6±7.0 cm3

Click to predict properties on the Chemicalize site


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