ChemSpider 2D Image | 2,4-Difluoro-N-(5-{3-[3-(1H-imidazol-1-yl)propyl]-4-oxo-3,4-dihydro-6-quinazolinyl}-2-methoxy-3-pyridinyl)benzenesulfonamide | C26H22F2N6O4S

2,4-Difluoro-N-(5-{3-[3-(1H-imidazol-1-yl)propyl]-4-oxo-3,4-dihydro-6-quinazolinyl}-2-methoxy-3-pyridinyl)benzenesulfonamide

  • Molecular FormulaC26H22F2N6O4S
  • Average mass552.552 Da
  • Monoisotopic mass552.139160 Da
  • ChemSpider ID90640681

More details:

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

2,4-Difluor-N-(5-{3-[3-(1H-imidazol-1-yl)propyl]-4-oxo-3,4-dihydro-6-chinazolinyl}-2-methoxy-3-pyridinyl)benzolsulfonamid [German] [ACD/IUPAC Name]
2,4-Difluoro-N-(5-{3-[3-(1H-imidazol-1-yl)propyl]-4-oxo-3,4-dihydro-6-quinazolinyl}-2-methoxy-3-pyridinyl)benzenesulfonamide [ACD/IUPAC Name]
2,4-Difluoro-N-(5-{3-[3-(1H-imidazol-1-yl)propyl]-4-oxo-3,4-dihydro-6-quinazolinyl}-2-méthoxy-3-pyridinyl)benzènesulfonamide [French] [ACD/IUPAC Name]
Benzenesulfonamide, N-[5-[3,4-dihydro-3-[3-(1H-imidazol-1-yl)propyl]-4-oxo-6-quinazolinyl]-2-methoxy-3-pyridinyl]-2,4-difluoro- [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: 787.5±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.6±3.0 kJ/mol
Flash Point: 430.1±35.7 °C
Index of Refraction: 1.672
Molar Refractivity: 141.3±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 3.29
ACD/LogD (pH 5.5): 1.26
ACD/BCF (pH 5.5): 2.42
ACD/KOC (pH 5.5): 25.86
ACD/LogD (pH 7.4): 1.70
ACD/BCF (pH 7.4): 6.68
ACD/KOC (pH 7.4): 71.31
Polar Surface Area: 127 Å2
Polarizability: 56.0±0.5 10-24cm3
Surface Tension: 55.6±7.0 dyne/cm
Molar Volume: 377.3±7.0 cm3

Click to predict properties on the Chemicalize site


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