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Search term: HOTKEWHGTJZXMM (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 7,8-Dimethyl-3-[2-(4-morpholinyl)ethyl]-1-(4-phenoxyphenyl)-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one | C26H31N5O3

7,8-Dimethyl-3-[2-(4-morpholinyl)ethyl]-1-(4-phenoxyphenyl)-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one

  • Molecular FormulaC26H31N5O3
  • Average mass461.556 Da
  • Monoisotopic mass461.242676 Da
  • ChemSpider ID23479173

More details:

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

6H-Pyrimido[1,2-a]-1,3,5-triazin-6-one, 1,2,3,4-tetrahydro-7,8-dimethyl-3-[2-(4-morpholinyl)ethyl]-1-(4-phenoxyphenyl)- [ACD/Index Name]
7,8-Dimethyl-3-[2-(4-morpholinyl)ethyl]-1-(4-phenoxyphenyl)-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-on [German] [ACD/IUPAC Name]
7,8-Dimethyl-3-[2-(4-morpholinyl)ethyl]-1-(4-phenoxyphenyl)-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one [ACD/IUPAC Name]
7,8-Diméthyl-3-[2-(4-morpholinyl)éthyl]-1-(4-phénoxyphényl)-1,2,3,4-tétrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one [French] [ACD/IUPAC Name]
7,8-dimethyl-3-[2-(morpholin-4-yl)ethyl]-1-(4-phenoxyphenyl)-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
1158741-53-7 [RN]
3-(3-Hydroxypropyl)-7,8-dimethyl-1-(4-phenoxyphenyl)-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, 1,2,3,4-tetrahydro-3-(3-hydroxypropyl)-7,8-dimethyl-1-(4-phenoxyphenyl)- [ACD/Index Name]
7,8-Dimethyl-3-(2-morpholin-4-yl-ethyl)-1-(4-phenoxy-phenyl)-1,2,3,4-tetrahydro-pyrimido[1,2-a][1,3,5]triazin-6-one
7,8-dimethyl-3-(2-morpholin-4-ylethyl)-1-(4-phenoxyphenyl)-2,4-dihydropyrimido[1,2-a][1,3,5]triazin-6-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: 587.3±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 87.7±3.0 kJ/mol
    Flash Point: 309.0±32.9 °C
    Index of Refraction: 1.643
    Molar Refractivity: 131.8±0.5 cm3
    #H bond acceptors: 8
    #H bond donors: 0
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 3.03
    ACD/LogD (pH 5.5): 1.15
    ACD/BCF (pH 5.5): 1.91
    ACD/KOC (pH 5.5): 20.66
    ACD/LogD (pH 7.4): 2.51
    ACD/BCF (pH 7.4): 43.68
    ACD/KOC (pH 7.4): 472.26
    Polar Surface Area: 61 Å2
    Polarizability: 52.2±0.5 10-24cm3
    Surface Tension: 50.0±7.0 dyne/cm
    Molar Volume: 364.5±7.0 cm3

    Click to predict properties on the Chemicalize site


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