ChemSpider 2D Image | 1-Ethyl-3-{[4-(4-methoxyphenyl)-1-piperazinyl]carbonyl}-6-(4-morpholinylsulfonyl)-4(1H)-quinolinone | C27H32N4O6S

1-Ethyl-3-{[4-(4-methoxyphenyl)-1-piperazinyl]carbonyl}-6-(4-morpholinylsulfonyl)-4(1H)-quinolinone

  • Molecular FormulaC27H32N4O6S
  • Average mass540.631 Da
  • Monoisotopic mass540.204285 Da
  • ChemSpider ID13137660

More details:

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

1-Ethyl-3-{[4-(4-methoxyphenyl)-1-piperazinyl]carbonyl}-6-(4-morpholinylsulfonyl)-4(1H)-chinolinon [German] [ACD/IUPAC Name]
1-Éthyl-3-{[4-(4-méthoxyphényl)-1-pipérazinyl]carbonyl}-6-(4-morpholinylsulfonyl)-4(1H)-quinoléinone [French] [ACD/IUPAC Name]
1-Ethyl-3-{[4-(4-methoxyphenyl)-1-piperazinyl]carbonyl}-6-(4-morpholinylsulfonyl)-4(1H)-quinolinone [ACD/IUPAC Name]
4(1H)-Quinolinone, 1-ethyl-3-[[4-(4-methoxyphenyl)-1-piperazinyl]carbonyl]-6-(4-morpholinylsulfonyl)- [ACD/Index Name]
1-ETHYL-3-[4-(4-METHOXYPHENYL)PIPERAZINE-1-CARBONYL]-6-(MORPHOLINE-4-SULFONYL)QUINOLIN-4-ONE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 777.7±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 113.2±3.0 kJ/mol
Flash Point: 424.1±35.7 °C
Index of Refraction: 1.625
Molar Refractivity: 142.5±0.4 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 0.74
ACD/LogD (pH 5.5): 1.25
ACD/BCF (pH 5.5): 5.24
ACD/KOC (pH 5.5): 113.65
ACD/LogD (pH 7.4): 1.25
ACD/BCF (pH 7.4): 5.28
ACD/KOC (pH 7.4): 114.48
Polar Surface Area: 108 Å2
Polarizability: 56.5±0.5 10-24cm3
Surface Tension: 56.4±3.0 dyne/cm
Molar Volume: 403.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement