ChemSpider 2D Image | N-{4-[(3-Bromophenyl)amino]-6-quinazolinyl}-4-(dimethylamino)-2-butenamide | C20H20BrN5O

N-{4-[(3-Bromophenyl)amino]-6-quinazolinyl}-4-(dimethylamino)-2-butenamide

  • Molecular FormulaC20H20BrN5O
  • Average mass426.310 Da
  • Monoisotopic mass425.085114 Da
  • ChemSpider ID26328982

More details:

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

2-Butenamide, N-[4-[(3-bromophenyl)amino]-6-quinazolinyl]-4-(dimethylamino)- [ACD/Index Name]
N-{4-[(3-Bromophenyl)amino]-6-quinazolinyl}-4-(dimethylamino)-2-butenamide [ACD/IUPAC Name]
N-{4-[(3-Bromophényl)amino]-6-quinazolinyl}-4-(diméthylamino)-2-buténamide [French] [ACD/IUPAC Name]
N-{4-[(3-Bromphenyl)amino]-6-chinazolinyl}-4-(dimethylamino)-2-butenamid [German] [ACD/IUPAC 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: 607.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.3±3.0 kJ/mol
Flash Point: 321.1±31.5 °C
Index of Refraction: 1.708
Molar Refractivity: 113.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.96
ACD/LogD (pH 5.5): 1.26
ACD/BCF (pH 5.5): 1.41
ACD/KOC (pH 5.5): 9.07
ACD/LogD (pH 7.4): 3.17
ACD/BCF (pH 7.4): 113.02
ACD/KOC (pH 7.4): 728.13
Polar Surface Area: 70 Å2
Polarizability: 45.2±0.5 10-24cm3
Surface Tension: 61.7±3.0 dyne/cm
Molar Volume: 292.2±3.0 cm3

Click to predict properties on the Chemicalize site


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