ChemSpider 2D Image | N-(3,4-Dichlorophenyl)-7-({3-[(dimethylamino)methyl]-1,2,4-oxadiazol-5-yl}methoxy)-6-methoxy-4-quinazolinamine | C21H20Cl2N6O3

N-(3,4-Dichlorophenyl)-7-({3-[(dimethylamino)methyl]-1,2,4-oxadiazol-5-yl}methoxy)-6-methoxy-4-quinazolinamine

  • Molecular FormulaC21H20Cl2N6O3
  • Average mass475.328 Da
  • Monoisotopic mass474.097382 Da
  • ChemSpider ID76728350

More details:

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

4-Quinazolinamine, N-(3,4-dichlorophenyl)-7-[[3-[(dimethylamino)methyl]-1,2,4-oxadiazol-5-yl]methoxy]-6-methoxy- [ACD/Index Name]
N-(3,4-Dichlorophenyl)-7-({3-[(dimethylamino)methyl]-1,2,4-oxadiazol-5-yl}methoxy)-6-methoxy-4-quinazolinamine [ACD/IUPAC Name]
N-(3,4-Dichlorophényl)-7-({3-[(diméthylamino)méthyl]-1,2,4-oxadiazol-5-yl}méthoxy)-6-méthoxy-4-quinazolinamine [French] [ACD/IUPAC Name]
N-(3,4-Dichlorphenyl)-7-({3-[(dimethylamino)methyl]-1,2,4-oxadiazol-5-yl}methoxy)-6-methoxy-4-chinazolinamin [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 622.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.2±3.0 kJ/mol
Flash Point: 330.3±34.3 °C
Index of Refraction: 1.661
Molar Refractivity: 123.7±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.87
ACD/LogD (pH 5.5): 3.20
ACD/BCF (pH 5.5): 103.43
ACD/KOC (pH 5.5): 581.50
ACD/LogD (pH 7.4): 3.95
ACD/BCF (pH 7.4): 584.30
ACD/KOC (pH 7.4): 3285.19
Polar Surface Area: 98 Å2
Polarizability: 49.0±0.5 10-24cm3
Surface Tension: 60.9±3.0 dyne/cm
Molar Volume: 334.5±3.0 cm3

Click to predict properties on the Chemicalize site


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