ChemSpider 2D Image | [(4-{[4-(Benzoylamino)phenyl]amino}-6-methoxy-7-quinazolinyl)oxy]acetic acid | C24H20N4O5

[(4-{[4-(Benzoylamino)phenyl]amino}-6-methoxy-7-quinazolinyl)oxy]acetic acid

  • Molecular FormulaC24H20N4O5
  • Average mass444.439 Da
  • Monoisotopic mass444.143372 Da
  • ChemSpider ID35033726

More details:

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

[(4-{[4-(Benzoylamino)phenyl]amino}-6-methoxy-7-chinazolinyl)oxy]essigsäure [German] [ACD/IUPAC Name]
[(4-{[4-(Benzoylamino)phenyl]amino}-6-methoxy-7-quinazolinyl)oxy]acetic acid [ACD/IUPAC Name]
[(4-{[4-(Benzoylamino)phenyl]amino}-6-Methoxyquinazolin-7-Yl)oxy]acetic Acid
Acetic acid, 2-[[4-[[4-(benzoylamino)phenyl]amino]-6-methoxy-7-quinazolinyl]oxy]- [ACD/Index Name]
Acide [(4-{[4-(benzoylamino)phényl]amino}-6-méthoxy-7-quinazolinyl)oxy]acétique [French] [ACD/IUPAC Name]
1S9
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL3343038/

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

Density: 1.4±0.1 g/cm3
Boiling Point: 596.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.4±3.0 kJ/mol
Flash Point: 314.5±30.1 °C
Index of Refraction: 1.718
Molar Refractivity: 123.8±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.08
ACD/LogD (pH 5.5): 0.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.68
ACD/LogD (pH 7.4): -0.96
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 123 Å2
Polarizability: 49.1±0.5 10-24cm3
Surface Tension: 69.7±3.0 dyne/cm
Molar Volume: 314.0±3.0 cm3

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