ChemSpider 2D Image | 2-[2-(3,4-Dihydro-1(2H)-quinolinyl)-2-oxoethyl]-9-(4-methoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3(2H)-one | C25H22N6O3

2-[2-(3,4-Dihydro-1(2H)-quinolinyl)-2-oxoethyl]-9-(4-methoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3(2H)-one

  • Molecular FormulaC25H22N6O3
  • Average mass454.481 Da
  • Monoisotopic mass454.175354 Da
  • ChemSpider ID26310329

More details:

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

2-[2-(3,4-Dihydro-1(2H)-chinolinyl)-2-oxoethyl]-9-(4-methoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3(2H)-on [German] [ACD/IUPAC Name]
2-[2-(3,4-Dihydro-1(2H)-quinoléinyl)-2-oxoéthyl]-9-(4-méthoxyphényl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3(2H)-one [French] [ACD/IUPAC Name]
2-[2-(3,4-Dihydro-1(2H)-quinolinyl)-2-oxoethyl]-9-(4-methoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3(2H)-one [ACD/IUPAC Name]
Pyrazolo[1,5-a]-1,2,4-triazolo[3,4-c]pyrazin-3(2H)-one, 2-[2-(3,4-dihydro-1(2H)-quinolinyl)-2-oxoethyl]-9-(4-methoxyphenyl)- [ACD/Index Name]
11-(4-methoxyphenyl)-4-[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]-3,4,6,9,10-pentaazatricyclo[7.3.0.02,6]dodeca-1(12),2,7,10-tetraen-5-one
1207058-12-5 [RN]
2-(2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl)-9-(4-methoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3(2H)-one
2-[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]-9-(4-methoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3(2H)-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: 636.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.0±3.0 kJ/mol
Flash Point: 338.5±34.3 °C
Index of Refraction: 1.738
Molar Refractivity: 127.3±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.54
ACD/LogD (pH 5.5): 2.55
ACD/BCF (pH 5.5): 50.91
ACD/KOC (pH 5.5): 579.90
ACD/LogD (pH 7.4): 2.55
ACD/BCF (pH 7.4): 50.91
ACD/KOC (pH 7.4): 579.92
Polar Surface Area: 83 Å2
Polarizability: 50.5±0.5 10-24cm3
Surface Tension: 62.6±7.0 dyne/cm
Molar Volume: 316.3±7.0 cm3

Click to predict properties on the Chemicalize site


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