ChemSpider 2D Image | 1-[3-Methyl-4-({3-[2-(methylamino)-4-pyrimidinyl]-2-pyridinyl}oxy)phenyl]-3-[3-(trifluoromethyl)phenyl]urea | C25H21F3N6O2

1-[3-Methyl-4-({3-[2-(methylamino)-4-pyrimidinyl]-2-pyridinyl}oxy)phenyl]-3-[3-(trifluoromethyl)phenyl]urea

  • Molecular FormulaC25H21F3N6O2
  • Average mass494.468 Da
  • Monoisotopic mass494.167816 Da
  • ChemSpider ID24694780

More details:

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

1-[3-Methyl-4-({3-[2-(methylamino)-4-pyrimidinyl]-2-pyridinyl}oxy)phenyl]-3-[3-(trifluormethyl)phenyl]harnstoff [German] [ACD/IUPAC Name]
1-[3-Methyl-4-({3-[2-(methylamino)-4-pyrimidinyl]-2-pyridinyl}oxy)phenyl]-3-[3-(trifluoromethyl)phenyl]urea [ACD/IUPAC Name]
1-[3-Méthyl-4-({3-[2-(méthylamino)-4-pyrimidinyl]-2-pyridinyl}oxy)phényl]-3-[3-(trifluorométhyl)phényl]urée [French] [ACD/IUPAC Name]
1-[3-Methyl-4-({3-[2-(Methylamino)pyrimidin-4-Yl]pyridin-2-Yl}oxy)phenyl]-3-[3-(Trifluoromethyl)phenyl]urea
Urea, N-[3-methyl-4-[[3-[2-(methylamino)-4-pyrimidinyl]-2-pyridinyl]oxy]phenyl]-N'-[3-(trifluoromethyl)phenyl]- [ACD/Index Name]
1-(3-methyl-4-(3-(2-(methylamino)pyrimidin-4-yl)pyridin-2-yloxy)phenyl)-3-(3-(trifluoromethyl)phenyl)urea
AK8
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL468612/

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.653
Molar Refractivity: 129.8±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.81
ACD/LogD (pH 5.5): 4.69
ACD/BCF (pH 5.5): 2160.44
ACD/KOC (pH 5.5): 8479.91
ACD/LogD (pH 7.4): 4.69
ACD/BCF (pH 7.4): 2161.48
ACD/KOC (pH 7.4): 8483.99
Polar Surface Area: 101 Å2
Polarizability: 51.5±0.5 10-24cm3
Surface Tension: 55.1±3.0 dyne/cm
Molar Volume: 354.6±3.0 cm3

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