ChemSpider 2D Image | 3-(3,5-Dibromo-4-hydroxybenzoyl)-2-ethyl-N-(4-sulfamoylphenyl)-1-benzofuran-6-sulfonamide | C23H18Br2N2O7S2

3-(3,5-Dibromo-4-hydroxybenzoyl)-2-ethyl-N-(4-sulfamoylphenyl)-1-benzofuran-6-sulfonamide

  • Molecular FormulaC23H18Br2N2O7S2
  • Average mass658.336 Da
  • Monoisotopic mass655.892212 Da
  • ChemSpider ID395392

More details:

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

3-(3,5-Dibrom-4-hydroxybenzoyl)-2-ethyl-N-(4-sulfamoylphenyl)-1-benzofuran-6-sulfonamid [German] [ACD/IUPAC Name]
3-(3,5-DIBROMO-4-HYDROXY-BENZOYL)-2-ETHYL-BENZOFURAN-6-SULFONIC ACID (4-SULFAMOYL-PHENYL)-AMIDE
3-(3,5-Dibromo-4-hydroxybenzoyl)-2-ethyl-N-(4-sulfamoylphenyl)-1-benzofuran-6-sulfonamide [ACD/IUPAC Name]
3-(3,5-Dibromo-4-hydroxybenzoyl)-2-éthyl-N-(4-sulfamoylphényl)-1-benzofurane-6-sulfonamide [French] [ACD/IUPAC Name]
6-Benzofuransulfonamide, N-[4-(aminosulfonyl)phenyl]-3-(3,5-dibromo-4-hydroxybenzoyl)-2-ethyl- [ACD/Index Name]
959324-50-6 [RN]
3-(3,5-dibromo-4-hydroxybenzoyl)-2-ethyl-N-(4-sulfamoylphenyl)benzofuran-6-sulfonamide
3-[(3,5-dibromo-4-hydroxyphenyl)carbonyl]-2-ethyl-N-(4-sulfamoylphenyl)-1-benzofuran-6-sulfonamide
MFCD28969659

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

892 [DBID]

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

    Density: 1.8±0.1 g/cm3
    Boiling Point: 803.4±75.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.9 mmHg at 25°C
    Enthalpy of Vaporization: 120.9±3.0 kJ/mol
    Flash Point: 439.7±37.1 °C
    Index of Refraction: 1.704
    Molar Refractivity: 142.1±0.4 cm3
    #H bond acceptors: 9
    #H bond donors: 4
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 2
    ACD/LogP: 5.80
    ACD/LogD (pH 5.5): 3.96
    ACD/BCF (pH 5.5): 339.20
    ACD/KOC (pH 5.5): 1131.55
    ACD/LogD (pH 7.4): 1.97
    ACD/BCF (pH 7.4): 3.46
    ACD/KOC (pH 7.4): 11.54
    Polar Surface Area: 174 Å2
    Polarizability: 56.3±0.5 10-24cm3
    Surface Tension: 71.9±3.0 dyne/cm
    Molar Volume: 366.1±3.0 cm3

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