ChemSpider 2D Image | 5-(3-Bromophenyl)-1-[3-(dimethylamino)propyl]-3-hydroxy-4-(4-isobutoxy-2-methylbenzoyl)-1,5-dihydro-2H-pyrrol-2-one | C27H33BrN2O4

5-(3-Bromophenyl)-1-[3-(dimethylamino)propyl]-3-hydroxy-4-(4-isobutoxy-2-methylbenzoyl)-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC27H33BrN2O4
  • Average mass529.466 Da
  • Monoisotopic mass528.162354 Da
  • ChemSpider ID11888843

More details:

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

2H-Pyrrol-2-one, 5-(3-bromophenyl)-1-[3-(dimethylamino)propyl]-1,5-dihydro-3-hydroxy-4-[2-methyl-4-(2-methylpropoxy)benzoyl]- [ACD/Index Name]
5-(3-Bromophenyl)-1-[3-(dimethylamino)propyl]-3-hydroxy-4-(4-isobutoxy-2-methylbenzoyl)-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
5-(3-Bromophényl)-1-[3-(diméthylamino)propyl]-3-hydroxy-4-(4-isobutoxy-2-méthylbenzoyl)-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]
5-(3-Bromphenyl)-1-[3-(dimethylamino)propyl]-3-hydroxy-4-(4-isobutoxy-2-methylbenzoyl)-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
(5S)-5-(3-bromophenyl)-1-[3-(dimethylamino)propyl]-4-[hydroxy-[2-methyl-4-(2-methylpropoxy)phenyl]methylidene]pyrrolidine-2,3-dione
1-[3-(dimethylamino)propyl]-5-(3-bromophenyl)-3-hydroxy-4-{[2-methyl-4-(2-methylpropoxy)phenyl]carbonyl}-3-pyrrolin-2-one
497868-16-3 [RN]
5-(3-bromophenyl)-1-(3-(dimethylamino)propyl)-3-hydroxy-4-(4-isobutoxy-2-methylbenzoyl)-1H-pyrrol-2(5H)-one
5-(3-bromophenyl)-1-[3-(dimethylamino)propyl]-3-hydroxy-4-[2-methyl-4-(2-methylpropoxy)benzoyl]-2,5-dihydro-1H-pyrrol-2-one
5-(3-bromophenyl)-1-[3-(dimethylamino)propyl]-3-hydroxy-4-{[2-methyl-4-(2-methylpropoxy)phenyl]carbonyl}-1,5-dihydro-2H-pyrrol-2-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: 662.1±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.1 mmHg at 25°C
    Enthalpy of Vaporization: 102.3±3.0 kJ/mol
    Flash Point: 354.2±31.5 °C
    Index of Refraction: 1.595
    Molar Refractivity: 137.4±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 2
    ACD/LogP: 5.89
    ACD/LogD (pH 5.5): 2.05
    ACD/BCF (pH 5.5): 5.21
    ACD/KOC (pH 5.5): 21.67
    ACD/LogD (pH 7.4): 2.07
    ACD/BCF (pH 7.4): 5.54
    ACD/KOC (pH 7.4): 23.05
    Polar Surface Area: 70 Å2
    Polarizability: 54.5±0.5 10-24cm3
    Surface Tension: 49.5±3.0 dyne/cm
    Molar Volume: 404.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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