ChemSpider 2D Image | Methyl 4-{4-hydroxy-3-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)carbonyl]-1-[3-(4-morpholinyl)propyl]-5-oxo-2,5-dihydro-1H-pyrrol-2-yl}benzoate | C29H32N2O7

Methyl 4-{4-hydroxy-3-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)carbonyl]-1-[3-(4-morpholinyl)propyl]-5-oxo-2,5-dihydro-1H-pyrrol-2-yl}benzoate

  • Molecular FormulaC29H32N2O7
  • Average mass520.574 Da
  • Monoisotopic mass520.220947 Da
  • ChemSpider ID21524825

More details:

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

4-{4-Hydroxy-3-[(2-méthyl-2,3-dihydro-1-benzofuran-5-yl)carbonyl]-1-[3-(4-morpholinyl)propyl]-5-oxo-2,5-dihydro-1H-pyrrol-2-yl}benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-[3-[(2,3-dihydro-2-methyl-5-benzofuranyl)carbonyl]-2,5-dihydro-4-hydroxy-1-[3-(4-morpholinyl)propyl]-5-oxo-1H-pyrrol-2-yl]-, methyl ester [ACD/Index Name]
Methyl 4-{4-hydroxy-3-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)carbonyl]-1-[3-(4-morpholinyl)propyl]-5-oxo-2,5-dihydro-1H-pyrrol-2-yl}benzoate [ACD/IUPAC Name]
methyl 4-{4-hydroxy-3-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)carbonyl]-1-[3-(morpholin-4-yl)propyl]-5-oxo-2,5-dihydro-1H-pyrrol-2-yl}benzoate
Methyl-4-{4-hydroxy-3-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)carbonyl]-1-[3-(4-morpholinyl)propyl]-5-oxo-2,5-dihydro-1H-pyrrol-2-yl}benzoat [German] [ACD/IUPAC Name]
4-[4-Hydroxy-3-(2-methyl-2,3-dihydro-benzofuran-5-carbonyl)-1-(3-morpholin-4-yl-propyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]-benzoic acid methyl ester
578719-79-6 [RN]
methyl 4-(4-hydroxy-3-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1-(3-morpholinopropyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate
methyl 4-{4-hydroxy-3-[(2-methyl(2,3-dihydrobenzo[b]furan-5-yl))carbonyl]-1-(3-morpholin-4-ylpropyl)-5-oxo-3-pyrrolin-2-yl}benzoate

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 734.9±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.5 mmHg at 25°C
    Enthalpy of Vaporization: 112.6±3.0 kJ/mol
    Flash Point: 398.3±32.9 °C
    Index of Refraction: 1.609
    Molar Refractivity: 138.7±0.3 cm3
    #H bond acceptors: 9
    #H bond donors: 1
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 1
    ACD/LogP: 3.33
    ACD/LogD (pH 5.5): 0.32
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 3.02
    ACD/LogD (pH 7.4): 0.01
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.50
    Polar Surface Area: 106 Å2
    Polarizability: 55.0±0.5 10-24cm3
    Surface Tension: 54.3±3.0 dyne/cm
    Molar Volume: 400.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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