ChemSpider 2D Image | 1-(3-{7-[1-(2-Cyano-1-phenylethyl)-1H-pyrazol-4-yl]imidazo[1,2-b]pyridazin-3-yl}phenyl)-3-(2,2,2-trifluoroethyl)urea | C27H21F3N8O

1-(3-{7-[1-(2-Cyano-1-phenylethyl)-1H-pyrazol-4-yl]imidazo[1,2-b]pyridazin-3-yl}phenyl)-3-(2,2,2-trifluoroethyl)urea

  • Molecular FormulaC27H21F3N8O
  • Average mass530.504 Da
  • Monoisotopic mass530.179016 Da
  • ChemSpider ID128989764

More details:

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

1-(3-{7-[1-(2-Cyan-1-phenylethyl)-1H-pyrazol-4-yl]imidazo[1,2-b]pyridazin-3-yl}phenyl)-3-(2,2,2-trifluorethyl)harnstoff [German] [ACD/IUPAC Name]
1-(3-{7-[1-(2-Cyano-1-phenylethyl)-1H-pyrazol-4-yl]imidazo[1,2-b]pyridazin-3-yl}phenyl)-3-(2,2,2-trifluoroethyl)urea [ACD/IUPAC Name]
1-(3-{7-[1-(2-Cyano-1-phényléthyl)-1H-pyrazol-4-yl]imidazo[1,2-b]pyridazin-3-yl}phényl)-3-(2,2,2-trifluoroéthyl)urée [French] [ACD/IUPAC Name]
Urea, N-[3-[7-[1-(2-cyano-1-phenylethyl)-1H-pyrazol-4-yl]imidazo[1,2-b]pyridazin-3-yl]phenyl]-N'-(2,2,2-trifluoroethyl)- [ACD/Index Name]

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: 1.667
Molar Refractivity: 140.3±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 3.39
ACD/LogD (pH 5.5): 3.25
ACD/BCF (pH 5.5): 173.02
ACD/KOC (pH 5.5): 1386.06
ACD/LogD (pH 7.4): 3.26
ACD/BCF (pH 7.4): 175.49
ACD/KOC (pH 7.4): 1405.76
Polar Surface Area: 113 Å2
Polarizability: 55.6±0.5 10-24cm3
Surface Tension: 53.1±7.0 dyne/cm
Molar Volume: 377.2±7.0 cm3

Click to predict properties on the Chemicalize site


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