ChemSpider 2D Image | 7-Hydroxy-5-methyl-6-(2-oxo-2-{4-[4-(trifluoromethyl)benzyl]-1-piperazinyl}ethyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile | C22H21F3N6O2

7-Hydroxy-5-methyl-6-(2-oxo-2-{4-[4-(trifluoromethyl)benzyl]-1-piperazinyl}ethyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile

  • Molecular FormulaC22H21F3N6O2
  • Average mass458.436 Da
  • Monoisotopic mass458.167816 Da
  • ChemSpider ID30027831

More details:

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

7-Hydroxy-5-methyl-6-(2-oxo-2-{4-[4-(trifluormethyl)benzyl]-1-piperazinyl}ethyl)pyrazolo[1,5-a]pyrimidin-3-carbonitril [German] [ACD/IUPAC Name]
7-Hydroxy-5-methyl-6-(2-oxo-2-{4-[4-(trifluoromethyl)benzyl]-1-piperazinyl}ethyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile [ACD/IUPAC Name]
7-Hydroxy-5-méthyl-6-(2-oxo-2-{4-[4-(trifluorométhyl)benzyl]-1-pipérazinyl}éthyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile [French] [ACD/IUPAC Name]
Pyrazolo[1,5-a]pyrimidine-3-carbonitrile, 7-hydroxy-5-methyl-6-[2-oxo-2-[4-[[4-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]ethyl]- [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: 1.643
Molar Refractivity: 115.3±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.66
ACD/LogD (pH 5.5): 0.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.31
ACD/LogD (pH 7.4): -1.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 98 Å2
Polarizability: 45.7±0.5 10-24cm3
Surface Tension: 51.3±7.0 dyne/cm
Molar Volume: 318.7±7.0 cm3

Click to predict properties on the Chemicalize site


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