ChemSpider 2D Image | 4-[3-(4-Ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-(4-methylphenyl)-1(2H)-phthalazinone | C26H22N4O4

4-[3-(4-Ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-(4-methylphenyl)-1(2H)-phthalazinone

  • Molecular FormulaC26H22N4O4
  • Average mass454.477 Da
  • Monoisotopic mass454.164093 Da
  • ChemSpider ID25185105

More details:

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

1(2H)-Phthalazinone, 4-[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-(4-methylphenyl)- [ACD/Index Name]
4-[3-(4-Éthoxy-3-méthoxyphényl)-1,2,4-oxadiazol-5-yl]-2-(4-méthylphényl)-1(2H)-phtalazinone [French] [ACD/IUPAC Name]
4-[3-(4-Ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-(4-methylphenyl)-1(2H)-phthalazinon [German] [ACD/IUPAC Name]
4-[3-(4-Ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-(4-methylphenyl)-1(2H)-phthalazinone [ACD/IUPAC Name]
1291862-07-1 [RN]
4-(3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl)-2-(p-tolyl)phthalazin-1(2H)-one
4-[3-(4-Ethoxy-3-methoxy-phenyl)-[1,2,4]oxadiazol-5-yl]-2-p-tolyl-2H-phthalazin-1-one
4-[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-(4-methylphenyl)-1,2-dihydrophthalazin-1-one
4-[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-(4-methylphenyl)phthalazin-1(2H)-one
4-[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-(4-methylphenyl)phthalazin-1-one
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 677.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.4±3.0 kJ/mol
Flash Point: 363.3±34.3 °C
Index of Refraction: 1.654
Molar Refractivity: 127.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.58
ACD/LogD (pH 5.5): 4.32
ACD/BCF (pH 5.5): 1132.87
ACD/KOC (pH 5.5): 5342.96
ACD/LogD (pH 7.4): 4.32
ACD/BCF (pH 7.4): 1132.87
ACD/KOC (pH 7.4): 5342.96
Polar Surface Area: 90 Å2
Polarizability: 50.4±0.5 10-24cm3
Surface Tension: 48.9±7.0 dyne/cm
Molar Volume: 347.2±7.0 cm3

Click to predict properties on the Chemicalize site


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