ChemSpider 2D Image | Ethyl 4-{[6-(diethylsulfamoyl)-1-methyl-4-oxo-1,4-dihydro-3-quinolinyl]carbonyl}-1-piperazinecarboxylate | C22H30N4O6S

Ethyl 4-{[6-(diethylsulfamoyl)-1-methyl-4-oxo-1,4-dihydro-3-quinolinyl]carbonyl}-1-piperazinecarboxylate

  • Molecular FormulaC22H30N4O6S
  • Average mass478.562 Da
  • Monoisotopic mass478.188599 Da
  • ChemSpider ID21903931

More details:

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

1-Piperazinecarboxylic acid, 4-[[6-[(diethylamino)sulfonyl]-1,4-dihydro-1-methyl-4-oxo-3-quinolinyl]carbonyl]-, ethyl ester [ACD/Index Name]
4-{[6-(Diéthylsulfamoyl)-1-méthyl-4-oxo-1,4-dihydro-3-quinoléinyl]carbonyl}-1-pipérazinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-{[6-(diethylsulfamoyl)-1-methyl-4-oxo-1,4-dihydro-3-quinolinyl]carbonyl}-1-piperazinecarboxylate [ACD/IUPAC Name]
Ethyl-4-{[6-(diethylsulfamoyl)-1-methyl-4-oxo-1,4-dihydro-3-chinolinyl]carbonyl}-1-piperazincarboxylat [German] [ACD/IUPAC Name]
ETHYL 4-[6-(DIETHYLSULFAMOYL)-1-METHYL-4-OXOQUINOLINE-3-CARBONYL]PIPERAZINE-1-CARBOXYLATE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 666.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.0±3.0 kJ/mol
Flash Point: 356.8±34.3 °C
Index of Refraction: 1.591
Molar Refractivity: 122.9±0.4 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 0.48
ACD/LogD (pH 5.5): 0.92
ACD/BCF (pH 5.5): 2.95
ACD/KOC (pH 5.5): 75.43
ACD/LogD (pH 7.4): 0.92
ACD/BCF (pH 7.4): 2.95
ACD/KOC (pH 7.4): 75.43
Polar Surface Area: 116 Å2
Polarizability: 48.7±0.5 10-24cm3
Surface Tension: 54.2±3.0 dyne/cm
Molar Volume: 363.7±3.0 cm3

Click to predict properties on the Chemicalize site


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