ChemSpider 2D Image | N,N-Diethyl-4-{[1-(4-ethyl-1-piperazinyl)-1-oxo-2-propanyl]oxy}-3-nitrobenzenesulfonamide | C19H30N4O6S

N,N-Diethyl-4-{[1-(4-ethyl-1-piperazinyl)-1-oxo-2-propanyl]oxy}-3-nitrobenzenesulfonamide

  • Molecular FormulaC19H30N4O6S
  • Average mass442.530 Da
  • Monoisotopic mass442.188599 Da
  • ChemSpider ID22767336

More details:

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

Benzenesulfonamide, N,N-diethyl-4-[2-(4-ethyl-1-piperazinyl)-1-methyl-2-oxoethoxy]-3-nitro- [ACD/Index Name]
N,N-Diethyl-4-{[1-(4-ethyl-1-piperazinyl)-1-oxo-2-propanyl]oxy}-3-nitrobenzenesulfonamide [ACD/IUPAC Name]
N,N-Diéthyl-4-{[1-(4-éthyl-1-pipérazinyl)-1-oxo-2-propanyl]oxy}-3-nitrobenzènesulfonamide [French] [ACD/IUPAC Name]
N,N-Diethyl-4-{[1-(4-ethyl-1-piperazinyl)-1-oxo-2-propanyl]oxy}-3-nitrobenzolsulfonamid [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 613.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.0±3.0 kJ/mol
Flash Point: 324.7±34.3 °C
Index of Refraction: 1.554
Molar Refractivity: 113.2±0.4 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 2.73
ACD/LogD (pH 5.5): 0.88
ACD/BCF (pH 5.5): 1.56
ACD/KOC (pH 5.5): 24.23
ACD/LogD (pH 7.4): 1.87
ACD/BCF (pH 7.4): 15.17
ACD/KOC (pH 7.4): 235.68
Polar Surface Area: 124 Å2
Polarizability: 44.9±0.5 10-24cm3
Surface Tension: 48.6±3.0 dyne/cm
Molar Volume: 353.1±3.0 cm3

Click to predict properties on the Chemicalize site


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