ChemSpider 2D Image | 1-(4-Fluorophenyl)-7,8-dimethyl-3-(3-pyridinylmethyl)-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one | C20H20FN5O

1-(4-Fluorophenyl)-7,8-dimethyl-3-(3-pyridinylmethyl)-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one

  • Molecular FormulaC20H20FN5O
  • Average mass365.404 Da
  • Monoisotopic mass365.165192 Da
  • ChemSpider ID23075887

More details:

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

1-(4-Fluorophenyl)-7,8-dimethyl-3-(3-pyridinylmethyl)-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one [ACD/IUPAC Name]
1-(4-Fluorophényl)-7,8-diméthyl-3-(3-pyridinylméthyl)-1,2,3,4-tétrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one [French] [ACD/IUPAC Name]
1-(4-Fluorphenyl)-7,8-dimethyl-3-(3-pyridinylmethyl)-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-on [German] [ACD/IUPAC Name]
6H-Pyrimido[1,2-a]-1,3,5-triazin-6-one, 1-(4-fluorophenyl)-1,2,3,4-tetrahydro-7,8-dimethyl-3-(3-pyridinylmethyl)- [ACD/Index Name]
1-(4-fluorophenyl)-7,8-dimethyl-3-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
1-(4-fluorophenyl)-7,8-dimethyl-3-(pyridin-3-ylmethyl)-2,4-dihydropyrimido[1,2-a][1,3,5]triazin-6-one
1-(4-Fluoro-phenyl)-7,8-dimethyl-3-pyridin-3-ylmethyl-1,2,3,4-tetrahydro-pyrimido[1,2-a][1,3,5]triazin-6-one
1144461-59-5 [RN]
3-(1,3-Benzodioxol-5-ylmethyl)-1-(4-fluorophenyl)-7,8-dimethyl-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one [ACD/IUPAC Name]
6H-Pyrimido[1,2-a]-1,3,5-triazin-6-one, 3-(1,3-benzodioxol-5-ylmethyl)-1-(4-fluorophenyl)-1,2,3,4-tetrahydro-7,8-dimethyl- [ACD/Index Name]
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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: 509.4±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 78.0±3.0 kJ/mol
    Flash Point: 261.9±32.9 °C
    Index of Refraction: 1.654
    Molar Refractivity: 102.9±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.12
    ACD/LogD (pH 5.5): 1.37
    ACD/BCF (pH 5.5): 6.20
    ACD/KOC (pH 5.5): 122.01
    ACD/LogD (pH 7.4): 1.45
    ACD/BCF (pH 7.4): 7.41
    ACD/KOC (pH 7.4): 145.84
    Polar Surface Area: 52 Å2
    Polarizability: 40.8±0.5 10-24cm3
    Surface Tension: 48.4±7.0 dyne/cm
    Molar Volume: 280.6±7.0 cm3

    Click to predict properties on the Chemicalize site


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