ChemSpider 2D Image | 1-(4-{2-[(6-{4-[2-(Dimethylamino)ethoxy]phenyl}furo[2,3-d]pyrimidin-4-yl)amino]ethyl}phenyl)-3-phenylurea | C31H32N6O3

1-(4-{2-[(6-{4-[2-(Dimethylamino)ethoxy]phenyl}furo[2,3-d]pyrimidin-4-yl)amino]ethyl}phenyl)-3-phenylurea

  • Molecular FormulaC31H32N6O3
  • Average mass536.624 Da
  • Monoisotopic mass536.253601 Da
  • ChemSpider ID30815550

More details:

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

1-(4-{2-[(6-{4-[2-(Dimethylamino)ethoxy]phenyl}furo[2,3-d]pyrimidin-4-yl)amino]ethyl}phenyl)-3-phenylharnstoff [German] [ACD/IUPAC Name]
1-(4-{2-[(6-{4-[2-(Dimethylamino)ethoxy]phenyl}furo[2,3-d]pyrimidin-4-yl)amino]ethyl}phenyl)-3-phenylurea [ACD/IUPAC Name]
1-(4-{2-[(6-{4-[2-(Diméthylamino)éthoxy]phényl}furo[2,3-d]pyrimidin-4-yl)amino]éthyl}phényl)-3-phénylurée [French] [ACD/IUPAC Name]
Urea, N-[4-[2-[[6-[4-[2-(dimethylamino)ethoxy]phenyl]furo[2,3-d]pyrimidin-4-yl]amino]ethyl]phenyl]-N'-phenyl- [ACD/Index Name]
WPH

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

Density: 1.3±0.1 g/cm3
Boiling Point: 675.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.2±3.0 kJ/mol
Flash Point: 362.2±31.5 °C
Index of Refraction: 1.690
Molar Refractivity: 159.0±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 5.30
ACD/LogD (pH 5.5): 2.60
ACD/BCF (pH 5.5): 11.35
ACD/KOC (pH 5.5): 30.42
ACD/LogD (pH 7.4): 4.21
ACD/BCF (pH 7.4): 469.01
ACD/KOC (pH 7.4): 1256.77
Polar Surface Area: 105 Å2
Polarizability: 63.0±0.5 10-24cm3
Surface Tension: 60.0±3.0 dyne/cm
Molar Volume: 415.9±3.0 cm3

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