ChemSpider 2D Image | 4-(3-Chloro-4-{ethyl[2-(4-pyridinyl)ethyl]amino}-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide | C25H25ClN6O4S

4-(3-Chloro-4-{ethyl[2-(4-pyridinyl)ethyl]amino}-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide

  • Molecular FormulaC25H25ClN6O4S
  • Average mass541.022 Da
  • Monoisotopic mass540.134644 Da
  • ChemSpider ID60130436

More details:

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

4-(3-Chlor-4-{ethyl[2-(4-pyridinyl)ethyl]amino}-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-N-(4,6-dimethyl-2-pyrimidinyl)benzolsulfonamid [German] [ACD/IUPAC Name]
4-(3-Chloro-4-{ethyl[2-(4-pyridinyl)ethyl]amino}-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide [ACD/IUPAC Name]
4-(3-Chloro-4-{éthyl[2-(4-pyridinyl)éthyl]amino}-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-N-(4,6-diméthyl-2-pyrimidinyl)benzènesulfonamide [French] [ACD/IUPAC Name]
Benzenesulfonamide, 4-[3-chloro-4-[ethyl[2-(4-pyridinyl)ethyl]amino]-2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl]-N-(4,6-dimethyl-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: 722.8±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.6±3.0 kJ/mol
Flash Point: 390.9±35.7 °C
Index of Refraction: 1.677
Molar Refractivity: 138.6±0.4 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 2.60
ACD/LogD (pH 5.5): 2.18
ACD/BCF (pH 5.5): 19.35
ACD/KOC (pH 5.5): 195.86
ACD/LogD (pH 7.4): 2.34
ACD/BCF (pH 7.4): 27.52
ACD/KOC (pH 7.4): 278.60
Polar Surface Area: 134 Å2
Polarizability: 54.9±0.5 10-24cm3
Surface Tension: 78.1±5.0 dyne/cm
Molar Volume: 367.9±5.0 cm3

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