ChemSpider 2D Image | 1-[4-(3-Amino-1H-indazol-4-yl)phenyl]-3-[2-fluoro-5-(hydroxymethyl)phenyl]urea | C21H18FN5O2

1-[4-(3-Amino-1H-indazol-4-yl)phenyl]-3-[2-fluoro-5-(hydroxymethyl)phenyl]urea

  • Molecular FormulaC21H18FN5O2
  • Average mass391.398 Da
  • Monoisotopic mass391.144440 Da
  • ChemSpider ID24808718

More details:

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

1-[4-(3-Amino-1H-indazol-4-yl)phenyl]-3-[2-fluor-5-(hydroxymethyl)phenyl]harnstoff [German] [ACD/IUPAC Name]
1-[4-(3-Amino-1H-indazol-4-yl)phenyl]-3-[2-fluoro-5-(hydroxymethyl)phenyl]urea [ACD/IUPAC Name]
1-[4-(3-Amino-1H-indazol-4-yl)phényl]-3-[2-fluoro-5-(hydroxyméthyl)phényl]urée [French] [ACD/IUPAC Name]
Urea, N-[4-(3-amino-1H-indazol-4-yl)phenyl]-N'-[2-fluoro-5-(hydroxymethyl)phenyl]- [ACD/Index Name]
Kinome_2193

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

Density: 1.5±0.1 g/cm3
Boiling Point: 595.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.3±3.0 kJ/mol
Flash Point: 313.9±30.1 °C
Index of Refraction: 1.791
Molar Refractivity: 110.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 6
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 2.69
ACD/LogD (pH 5.5): 2.77
ACD/BCF (pH 5.5): 74.73
ACD/KOC (pH 5.5): 759.56
ACD/LogD (pH 7.4): 2.78
ACD/BCF (pH 7.4): 75.82
ACD/KOC (pH 7.4): 770.68
Polar Surface Area: 116 Å2
Polarizability: 43.9±0.5 10-24cm3
Surface Tension: 80.8±3.0 dyne/cm
Molar Volume: 261.1±3.0 cm3

Click to predict properties on the Chemicalize site


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