ChemSpider 2D Image | 2-{[5,7-Dichloro-2-(4-methyl-1-piperazinyl)-4-quinazolinyl]amino}-N-phenylethanesulfonamide | C21H24Cl2N6O2S

2-{[5,7-Dichloro-2-(4-methyl-1-piperazinyl)-4-quinazolinyl]amino}-N-phenylethanesulfonamide

  • Molecular FormulaC21H24Cl2N6O2S
  • Average mass495.425 Da
  • Monoisotopic mass494.105835 Da
  • ChemSpider ID24643643

More details:

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

2-{[5,7-Dichlor-2-(4-methyl-1-piperazinyl)-4-chinazolinyl]amino}-N-phenylethansulfonamid [German] [ACD/IUPAC Name]
2-{[5,7-Dichloro-2-(4-methyl-1-piperazinyl)-4-quinazolinyl]amino}-N-phenylethanesulfonamide [ACD/IUPAC Name]
2-{[5,7-Dichloro-2-(4-méthyl-1-pipérazinyl)-4-quinazolinyl]amino}-N-phényléthanesulfonamide [French] [ACD/IUPAC Name]
Ethanesulfonamide, 2-[[5,7-dichloro-2-(4-methyl-1-piperazinyl)-4-quinazolinyl]amino]-N-phenyl- [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: 706.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.3±3.0 kJ/mol
Flash Point: 381.0±35.7 °C
Index of Refraction: 1.685
Molar Refractivity: 128.5±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.48
ACD/LogD (pH 5.5): 0.96
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.27
ACD/LogD (pH 7.4): 1.83
ACD/BCF (pH 7.4): 5.00
ACD/KOC (pH 7.4): 31.27
Polar Surface Area: 99 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 72.3±3.0 dyne/cm
Molar Volume: 338.1±3.0 cm3

Click to predict properties on the Chemicalize site


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