ChemSpider 2D Image | 3-Hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-{4-[(3-methylbenzyl)oxy]benzoyl}-5-(4-pyridinyl)-1,5-dihydro-2H-pyrrol-2-one | C30H28N4O4

3-Hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-{4-[(3-methylbenzyl)oxy]benzoyl}-5-(4-pyridinyl)-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC30H28N4O4
  • Average mass508.568 Da
  • Monoisotopic mass508.211060 Da
  • ChemSpider ID21524367

More details:

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

2H-Pyrrol-2-one, 1,5-dihydro-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-[4-[(3-methylphenyl)methoxy]benzoyl]-5-(4-pyridinyl)- [ACD/Index Name]
3-Hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-{4-[(3-methylbenzyl)oxy]benzoyl}-5-(4-pyridinyl)-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
3-Hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-{4-[(3-methylbenzyl)oxy]benzoyl}-5-(4-pyridinyl)-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
3-Hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-{4-[(3-méthylbenzyl)oxy]benzoyl}-5-(4-pyridinyl)-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]
3-Hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-{4-[(3-methylbenzyl)oxy]benzoyl}-5-(pyridin-4-yl)-1,5-dihydro-2H-pyrrol-2-one
1-(3-(1H-imidazol-1-yl)propyl)-3-hydroxy-4-(4-((3-methylbenzyl)oxy)benzoyl)-5-(pyridin-4-yl)-1H-pyrrol-2(5H)-one
3-hydroxy-1-(3-imidazolylpropyl)-4-({4-[(3-methylphenyl)methoxy]phenyl}carbonyl)-5-(4-pyridyl)-3-pyrrolin-2-one
3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-({4-[(3-methylbenzyl)oxy]phenyl}carbonyl)-5-(pyridin-4-yl)-1,5-dihydro-2H-pyrrol-2-one
3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-{4-[(3-methylphenyl)methoxy]benzoyl}-5-(pyridin-4-yl)-2,5-dihydro-1H-pyrrol-2-one
840460-58-4 [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: 789.0±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.9 mmHg at 25°C
    Enthalpy of Vaporization: 120.4±3.0 kJ/mol
    Flash Point: 431.0±32.9 °C
    Index of Refraction: 1.648
    Molar Refractivity: 145.8±0.5 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 1
    ACD/LogP: 3.59
    ACD/LogD (pH 5.5): 0.52
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 4.13
    ACD/LogD (pH 7.4): 0.11
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.61
    Polar Surface Area: 98 Å2
    Polarizability: 57.8±0.5 10-24cm3
    Surface Tension: 51.8±7.0 dyne/cm
    Molar Volume: 400.7±7.0 cm3

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