ChemSpider 2D Image | 4-({4-Chloro-1-[4-(diethylamino)phenyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}amino)-N-(4-methyl-2-pyrimidinyl)benzenesulfonamide | C25H25ClN6O4S

4-({4-Chloro-1-[4-(diethylamino)phenyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}amino)-N-(4-methyl-2-pyrimidinyl)benzenesulfonamide

  • Molecular FormulaC25H25ClN6O4S
  • Average mass541.022 Da
  • Monoisotopic mass540.134644 Da
  • ChemSpider ID60087300

More details:

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

4-({4-Chlor-1-[4-(diethylamino)phenyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}amino)-N-(4-methyl-2-pyrimidinyl)benzolsulfonamid [German] [ACD/IUPAC Name]
4-({4-Chloro-1-[4-(diethylamino)phenyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}amino)-N-(4-methyl-2-pyrimidinyl)benzenesulfonamide [ACD/IUPAC Name]
4-({4-Chloro-1-[4-(diéthylamino)phényl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}amino)-N-(4-méthyl-2-pyrimidinyl)benzènesulfonamide [French] [ACD/IUPAC Name]
Benzenesulfonamide, 4-[[4-chloro-1-[4-(diethylamino)phenyl]-2,5-dihydro-2,5-dioxo-1H-pyrrol-3-yl]amino]-N-(4-methyl-2-pyrimidinyl)- [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: 715.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.5±3.0 kJ/mol
Flash Point: 386.2±35.7 °C
Index of Refraction: 1.688
Molar Refractivity: 139.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 3.34
ACD/LogD (pH 5.5): 1.91
ACD/BCF (pH 5.5): 7.68
ACD/KOC (pH 5.5): 59.76
ACD/LogD (pH 7.4): 2.62
ACD/BCF (pH 7.4): 39.04
ACD/KOC (pH 7.4): 303.79
Polar Surface Area: 133 Å2
Polarizability: 55.4±0.5 10-24cm3
Surface Tension: 77.3±5.0 dyne/cm
Molar Volume: 366.4±5.0 cm3

Click to predict properties on the Chemicalize site


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