ChemSpider 2D Image | 1-[3-(Dimethylamino)propyl]-5-(4-ethoxyphenyl)-3-hydroxy-4-{4-[(3-methylbenzyl)oxy]benzoyl}-1,5-dihydro-2H-pyrrol-2-one | C32H36N2O5

1-[3-(Dimethylamino)propyl]-5-(4-ethoxyphenyl)-3-hydroxy-4-{4-[(3-methylbenzyl)oxy]benzoyl}-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC32H36N2O5
  • Average mass528.639 Da
  • Monoisotopic mass528.262451 Da
  • ChemSpider ID21524142

More details:

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

1-[3-(Dimethylamino)propyl]-5-(4-ethoxyphenyl)-3-hydroxy-4-{4-[(3-methylbenzyl)oxy]benzoyl}-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
1-[3-(Dimethylamino)propyl]-5-(4-ethoxyphenyl)-3-hydroxy-4-{4-[(3-methylbenzyl)oxy]benzoyl}-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
1-[3-(Diméthylamino)propyl]-5-(4-éthoxyphényl)-3-hydroxy-4-{4-[(3-méthylbenzyl)oxy]benzoyl}-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]
2H-Pyrrol-2-one, 1-[3-(dimethylamino)propyl]-5-(4-ethoxyphenyl)-1,5-dihydro-3-hydroxy-4-[4-[(3-methylphenyl)methoxy]benzoyl]- [ACD/Index Name]
1-(3-(dimethylamino)propyl)-5-(4-ethoxyphenyl)-3-hydroxy-4-(4-((3-methylbenzyl)oxy)benzoyl)-1H-pyrrol-2(5H)-one
1-[3-(dimethylamino)propyl]-5-(4-ethoxyphenyl)-3-hydroxy-4-({4-[(3-methylbenzyl)oxy]phenyl}carbonyl)-1,5-dihydro-2H-pyrrol-2-one
1-[3-(dimethylamino)propyl]-5-(4-ethoxyphenyl)-3-hydroxy-4-({4-[(3-methylphenyl)methoxy]phenyl}carbonyl)-3-pyrrolin-2-one
1-[3-(dimethylamino)propyl]-5-(4-ethoxyphenyl)-3-hydroxy-4-{4-[(3-methylphenyl)methoxy]benzoyl}-2,5-dihydro-1H-pyrrol-2-one
835908-41-3 [RN]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 711.3±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.4 mmHg at 25°C
    Enthalpy of Vaporization: 109.2±3.0 kJ/mol
    Flash Point: 384.0±32.9 °C
    Index of Refraction: 1.606
    Molar Refractivity: 151.7±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 12
    #Rule of 5 Violations: 2
    ACD/LogP: 5.80
    ACD/LogD (pH 5.5): 2.22
    ACD/BCF (pH 5.5): 7.04
    ACD/KOC (pH 5.5): 26.89
    ACD/LogD (pH 7.4): 2.24
    ACD/BCF (pH 7.4): 7.49
    ACD/KOC (pH 7.4): 28.60
    Polar Surface Area: 79 Å2
    Polarizability: 60.1±0.5 10-24cm3
    Surface Tension: 51.3±3.0 dyne/cm
    Molar Volume: 439.6±3.0 cm3

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