ChemSpider 2D Image | 3-({(E)-[3-(4-Methylphenyl)-1H-pyrazol-4-yl]methylene}amino)-2-(phenoxymethyl)quinazolin-4(3H)-one | C26H21N5O2

3-({(E)-[3-(4-Methylphenyl)-1H-pyrazol-4-yl]methylene}amino)-2-(phenoxymethyl)quinazolin-4(3H)-one

  • Molecular FormulaC26H21N5O2
  • Average mass435.477 Da
  • Monoisotopic mass435.169525 Da
  • ChemSpider ID22849198

  • Double-bond stereo - Double-bond stereo

More details:

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

3-({(E)-[3-(4-Methylphenyl)-1H-pyrazol-4-yl]methylene}amino)-2-(phenoxymethyl)quinazolin-4(3H)-one
3-[(E)-{[3-(4-Methylphenyl)-1H-pyrazol-4-yl]methylen}amino]-2-(phenoxymethyl)-4(3H)-chinazolinon [German] [ACD/IUPAC Name]
3-[(E)-{[3-(4-Methylphenyl)-1H-pyrazol-4-yl]methylene}amino]-2-(phenoxymethyl)-4(3H)-quinazolinone [ACD/IUPAC Name]
3-[(E)-{[3-(4-Méthylphényl)-1H-pyrazol-4-yl]méthylène}amino]-2-(phénoxyméthyl)-4(3H)-quinazolinone [French] [ACD/IUPAC Name]
4(3H)-Quinazolinone, 3-[[(1E)-[3-(4-methylphenyl)-1H-pyrazol-4-yl]methylene]amino]-2-(phenoxymethyl)- [ACD/Index Name]
(E)-2-(phenoxymethyl)-3-(((3-(p-tolyl)-1H-pyrazol-4-yl)methylene)amino)quinazolin-4(3H)-one
2-(phenoxymethyl)-3-[[(E)-[3-(p-tolyl)pyrazol-4-ylidene]methyl]amino]quinazolin-4-one
2-Phenoxymethyl-3-[(3-p-tolyl-1H-pyrazol-4-ylmethylene)-amino]-3H-quinazolin-4-one
3-({(E)-[3-(4-methylphenyl)-1H-pyrazol-4-yl]methylidene}amino)-2-(phenoxymethyl)quinazolin-4(3H)-one
381691-72-1 [RN]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 703.6±70.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.2 mmHg at 25°C
    Enthalpy of Vaporization: 103.0±3.0 kJ/mol
    Flash Point: 379.3±35.7 °C
    Index of Refraction: 1.674
    Molar Refractivity: 127.9±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 4.77
    ACD/LogD (pH 5.5): 4.24
    ACD/BCF (pH 5.5): 975.64
    ACD/KOC (pH 5.5): 4801.00
    ACD/LogD (pH 7.4): 4.24
    ACD/BCF (pH 7.4): 975.61
    ACD/KOC (pH 7.4): 4800.84
    Polar Surface Area: 83 Å2
    Polarizability: 50.7±0.5 10-24cm3
    Surface Tension: 52.0±7.0 dyne/cm
    Molar Volume: 340.7±7.0 cm3

    Click to predict properties on the Chemicalize site


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