ChemSpider 2D Image | 4-[3-Hydroxy-5-(4-hydroxy-3-nitrophenyl)-2-oxo-4-(2-thienyl)-2,5-dihydro-1H-pyrrol-1-yl]benzenesulfonamide | C20H15N3O7S2

4-[3-Hydroxy-5-(4-hydroxy-3-nitrophenyl)-2-oxo-4-(2-thienyl)-2,5-dihydro-1H-pyrrol-1-yl]benzenesulfonamide

  • Molecular FormulaC20H15N3O7S2
  • Average mass473.479 Da
  • Monoisotopic mass473.035126 Da
  • ChemSpider ID60066896

More details:

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

4-[3-Hydroxy-5-(4-hydroxy-3-nitrophenyl)-2-oxo-4-(2-thienyl)-2,5-dihydro-1H-pyrrol-1-yl]benzenesulfonamide [ACD/IUPAC Name]
4-[3-Hydroxy-5-(4-hydroxy-3-nitrophényl)-2-oxo-4-(2-thiényl)-2,5-dihydro-1H-pyrrol-1-yl]benzènesulfonamide [French] [ACD/IUPAC Name]
4-[3-Hydroxy-5-(4-hydroxy-3-nitrophenyl)-2-oxo-4-(2-thienyl)-2,5-dihydro-1H-pyrrol-1-yl]benzolsulfonamid [German] [ACD/IUPAC Name]
Benzenesulfonamide, 4-[2,5-dihydro-3-hydroxy-5-(4-hydroxy-3-nitrophenyl)-2-oxo-4-(2-thienyl)-1H-pyrrol-1-yl]- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 702.4±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 107.9±3.0 kJ/mol
Flash Point: 378.6±35.7 °C
Index of Refraction: 1.751
Molar Refractivity: 115.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 2.26
ACD/LogD (pH 5.5): 1.57
ACD/BCF (pH 5.5): 9.00
ACD/KOC (pH 5.5): 163.35
ACD/LogD (pH 7.4): 0.66
ACD/BCF (pH 7.4): 1.11
ACD/KOC (pH 7.4): 20.21
Polar Surface Area: 203 Å2
Polarizability: 45.9±0.5 10-24cm3
Surface Tension: 89.7±3.0 dyne/cm
Molar Volume: 283.8±3.0 cm3

Click to predict properties on the Chemicalize site


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