ChemSpider 2D Image | 1-[4-(3-Methyl-1H-indazol-4-yl)phenyl]-3-[3-(trifluoromethyl)phenyl]urea | C22H17F3N4O

1-[4-(3-Methyl-1H-indazol-4-yl)phenyl]-3-[3-(trifluoromethyl)phenyl]urea

  • Molecular FormulaC22H17F3N4O
  • Average mass410.392 Da
  • Monoisotopic mass410.135437 Da
  • ChemSpider ID24809055

More details:

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

1-[4-(3-Methyl-1H-indazol-4-yl)phenyl]-3-[3-(trifluormethyl)phenyl]harnstoff [German] [ACD/IUPAC Name]
1-[4-(3-Methyl-1H-indazol-4-yl)phenyl]-3-[3-(trifluoromethyl)phenyl]urea [ACD/IUPAC Name]
1-[4-(3-Méthyl-1H-indazol-4-yl)phényl]-3-[3-(trifluorométhyl)phényl]urée [French] [ACD/IUPAC Name]
Urea, N-[4-(3-methyl-1H-indazol-4-yl)phenyl]-N'-[3-(trifluoromethyl)phenyl]- [ACD/Index Name]
Kinome_563

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

Density: 1.4±0.1 g/cm3
Boiling Point: 495.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.3±3.0 kJ/mol
Flash Point: 253.4±28.7 °C
Index of Refraction: 1.680
Molar Refractivity: 109.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 6.34
ACD/LogD (pH 5.5): 5.58
ACD/BCF (pH 5.5): 10297.42
ACD/KOC (pH 5.5): 25933.00
ACD/LogD (pH 7.4): 5.58
ACD/BCF (pH 7.4): 10301.04
ACD/KOC (pH 7.4): 25942.14
Polar Surface Area: 70 Å2
Polarizability: 43.5±0.5 10-24cm3
Surface Tension: 55.0±3.0 dyne/cm
Molar Volume: 290.6±3.0 cm3

Click to predict properties on the Chemicalize site


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