ChemSpider 2D Image | 2-(1,3-Benzodioxol-5-yl)-5-{[2-(4-ethoxy-3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}pyrazolo[1,5-a]pyrazin-4(5H)-one | C27H24N4O6

2-(1,3-Benzodioxol-5-yl)-5-{[2-(4-ethoxy-3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}pyrazolo[1,5-a]pyrazin-4(5H)-one

  • Molecular FormulaC27H24N4O6
  • Average mass500.503 Da
  • Monoisotopic mass500.169586 Da
  • ChemSpider ID29053534

More details:

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

2-(1,3-Benzodioxol-5-yl)-5-{[2-(4-ethoxy-3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}pyrazolo[1,5-a]pyrazin-4(5H)-on [German] [ACD/IUPAC Name]
2-(1,3-Benzodioxol-5-yl)-5-{[2-(4-ethoxy-3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}pyrazolo[1,5-a]pyrazin-4(5H)-one [ACD/IUPAC Name]
2-(1,3-Benzodioxol-5-yl)-5-{[2-(4-éthoxy-3-méthoxyphényl)-5-méthyl-1,3-oxazol-4-yl]méthyl}pyrazolo[1,5-a]pyrazin-4(5H)-one [French] [ACD/IUPAC Name]
Pyrazolo[1,5-a]pyrazin-4(5H)-one, 2-(1,3-benzodioxol-5-yl)-5-[[2-(4-ethoxy-3-methoxyphenyl)-5-methyl-4-oxazolyl]methyl]- [ACD/Index Name]
1276342-84-7 [RN]
2-(2H-1,3-benzodioxol-5-yl)-5-{[2-(4-ethoxy-3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-4H,5H-pyrazolo[1,5-a]pyrazin-4-one
2-(benzo[d][1,3]dioxol-5-yl)-5-((2-(4-ethoxy-3-methoxyphenyl)-5-methyloxazol-4-yl)methyl)pyrazolo[1,5-a]pyrazin-4(5H)-one

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

Density: 1.4±0.1 g/cm3
Boiling Point: 656.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.7±3.0 kJ/mol
Flash Point: 350.9±34.3 °C
Index of Refraction: 1.675
Molar Refractivity: 132.9±0.5 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 4.47
ACD/LogD (pH 5.5): 3.20
ACD/BCF (pH 5.5): 159.01
ACD/KOC (pH 5.5): 1310.31
ACD/LogD (pH 7.4): 3.20
ACD/BCF (pH 7.4): 159.01
ACD/KOC (pH 7.4): 1310.34
Polar Surface Area: 101 Å2
Polarizability: 52.7±0.5 10-24cm3
Surface Tension: 53.1±7.0 dyne/cm
Molar Volume: 353.7±7.0 cm3

Click to predict properties on the Chemicalize site


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