ChemSpider 2D Image | 4-{2-[4-(5-Chloro-2-methylphenyl)-1-piperazinyl]-2-oxoethoxy}-N-(4-fluorophenyl)benzenesulfonamide | C25H25ClFN3O4S

4-{2-[4-(5-Chloro-2-methylphenyl)-1-piperazinyl]-2-oxoethoxy}-N-(4-fluorophenyl)benzenesulfonamide

  • Molecular FormulaC25H25ClFN3O4S
  • Average mass518.000 Da
  • Monoisotopic mass517.123840 Da
  • ChemSpider ID2244529

More details:

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

4-{2-[4-(5-Chlor-2-methylphenyl)-1-piperazinyl]-2-oxoethoxy}-N-(4-fluorphenyl)benzolsulfonamid [German] [ACD/IUPAC Name]
4-{2-[4-(5-Chloro-2-methylphenyl)-1-piperazinyl]-2-oxoethoxy}-N-(4-fluorophenyl)benzenesulfonamide [ACD/IUPAC Name]
4-{2-[4-(5-Chloro-2-méthylphényl)-1-pipérazinyl]-2-oxoéthoxy}-N-(4-fluorophényl)benzènesulfonamide [French] [ACD/IUPAC Name]
Benzenesulfonamide, 4-[2-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-2-oxoethoxy]-N-(4-fluorophenyl)- [ACD/Index Name]
4-{2-[4-(5-CHLORO-2-METHYLPHENYL)PIPERAZIN-1-YL]-2-OXOETHOXY}-N-(4-FLUOROPHENYL)BENZENE-1-SULFONAMIDE
4-{2-[4-(5-CHLORO-2-METHYLPHENYL)PIPERAZIN-1-YL]-2-OXOETHOXY}-N-(4-FLUOROPHENYL)BENZENESULFONAMIDE

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

Density: 1.4±0.1 g/cm3
Boiling Point: 714.4±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.4±3.0 kJ/mol
Flash Point: 385.8±35.7 °C
Index of Refraction: 1.633
Molar Refractivity: 133.6±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 5.10
ACD/LogD (pH 5.5): 4.53
ACD/BCF (pH 5.5): 1623.16
ACD/KOC (pH 5.5): 6906.67
ACD/LogD (pH 7.4): 4.46
ACD/BCF (pH 7.4): 1385.91
ACD/KOC (pH 7.4): 5897.15
Polar Surface Area: 87 Å2
Polarizability: 53.0±0.5 10-24cm3
Surface Tension: 57.4±3.0 dyne/cm
Molar Volume: 374.0±3.0 cm3

Click to predict properties on the Chemicalize site


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