ChemSpider 2D Image | 1-[4-(3-Amino-1H-indazol-4-yl)-2-fluorophenyl]-3-[3-(trifluoromethyl)phenyl]urea | C21H15F4N5O

1-[4-(3-Amino-1H-indazol-4-yl)-2-fluorophenyl]-3-[3-(trifluoromethyl)phenyl]urea

  • Molecular FormulaC21H15F4N5O
  • Average mass429.370 Da
  • Monoisotopic mass429.121277 Da
  • ChemSpider ID24808585

More details:

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

1-[4-(3-Amino-1H-indazol-4-yl)-2-fluorophenyl]-3-[3-(trifluoromethyl)phenyl]urea [ACD/IUPAC Name]
1-[4-(3-Amino-1H-indazol-4-yl)-2-fluorophényl]-3-[3-(trifluorométhyl)phényl]urée [French] [ACD/IUPAC Name]
1-[4-(3-Amino-1H-indazol-4-yl)-2-fluorphenyl]-3-[3-(trifluormethyl)phenyl]harnstoff [German] [ACD/IUPAC Name]
Urea, N-[4-(3-amino-1H-indazol-4-yl)-2-fluorophenyl]-N'-[3-(trifluoromethyl)phenyl]- [ACD/Index Name]
Kinome_2672

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

Density: 1.5±0.1 g/cm3
Boiling Point: 528.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.3±3.0 kJ/mol
Flash Point: 273.2±30.1 °C
Index of Refraction: 1.706
Molar Refractivity: 109.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 5.20
ACD/LogD (pH 5.5): 4.85
ACD/BCF (pH 5.5): 2865.02
ACD/KOC (pH 5.5): 10367.58
ACD/LogD (pH 7.4): 4.85
ACD/BCF (pH 7.4): 2876.61
ACD/KOC (pH 7.4): 10409.54
Polar Surface Area: 96 Å2
Polarizability: 43.3±0.5 10-24cm3
Surface Tension: 61.6±3.0 dyne/cm
Molar Volume: 280.8±3.0 cm3

Click to predict properties on the Chemicalize site


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