ChemSpider 2D Image | 4-{[4-(2,4-Difluorophenyl)-1-(4-isopropoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}benzenesulfonamide | C25H21F2N3O5S

4-{[4-(2,4-Difluorophenyl)-1-(4-isopropoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}benzenesulfonamide

  • Molecular FormulaC25H21F2N3O5S
  • Average mass513.513 Da
  • Monoisotopic mass513.117004 Da
  • ChemSpider ID118688557

More details:

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

4-{[4-(2,4-Difluorophenyl)-1-(4-isopropoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}benzenesulfonamide [ACD/IUPAC Name]
4-{[4-(2,4-Difluorophényl)-1-(4-isopropoxyphényl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}benzènesulfonamide [French] [ACD/IUPAC Name]
4-{[4-(2,4-Difluorphenyl)-1-(4-isopropoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}benzolsulfonamid [German] [ACD/IUPAC Name]
Benzenesulfonamide, 4-[[4-(2,4-difluorophenyl)-2,5-dihydro-1-[4-(1-methylethoxy)phenyl]-2,5-dioxo-1H-pyrrol-3-yl]amino]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 677.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.5±3.0 kJ/mol
Flash Point: 363.6±34.3 °C
Index of Refraction: 1.653
Molar Refractivity: 128.1±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 3.35
ACD/LogD (pH 5.5): 2.98
ACD/BCF (pH 5.5): 109.16
ACD/KOC (pH 5.5): 1001.02
ACD/LogD (pH 7.4): 2.98
ACD/BCF (pH 7.4): 108.96
ACD/KOC (pH 7.4): 999.23
Polar Surface Area: 127 Å2
Polarizability: 50.8±0.5 10-24cm3
Surface Tension: 62.9±3.0 dyne/cm
Molar Volume: 350.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement