ChemSpider 2D Image | 2-[5-({4-[3-(Trifluoromethyl)phenyl]-1-piperazinyl}methyl)-1,2,4-oxadiazol-3-yl]pyrazine | C18H17F3N6O

2-[5-({4-[3-(Trifluoromethyl)phenyl]-1-piperazinyl}methyl)-1,2,4-oxadiazol-3-yl]pyrazine

  • Molecular FormulaC18H17F3N6O
  • Average mass390.362 Da
  • Monoisotopic mass390.141602 Da
  • ChemSpider ID22213732

More details:

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

2-[5-({4-[3-(Trifluormethyl)phenyl]-1-piperazinyl}methyl)-1,2,4-oxadiazol-3-yl]pyrazin [German] [ACD/IUPAC Name]
2-[5-({4-[3-(Trifluoromethyl)phenyl]-1-piperazinyl}methyl)-1,2,4-oxadiazol-3-yl]pyrazine [ACD/IUPAC Name]
2-[5-({4-[3-(Trifluorométhyl)phényl]-1-pipérazinyl}méthyl)-1,2,4-oxadiazol-3-yl]pyrazine [French] [ACD/IUPAC Name]
Pyrazine, 2-[5-[[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methyl]-1,2,4-oxadiazol-3-yl]- [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: 532.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.8±3.0 kJ/mol
Flash Point: 275.8±32.9 °C
Index of Refraction: 1.568
Molar Refractivity: 93.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.46
ACD/LogD (pH 5.5): 3.00
ACD/BCF (pH 5.5): 108.54
ACD/KOC (pH 5.5): 957.11
ACD/LogD (pH 7.4): 3.06
ACD/BCF (pH 7.4): 125.07
ACD/KOC (pH 7.4): 1102.85
Polar Surface Area: 71 Å2
Polarizability: 37.0±0.5 10-24cm3
Surface Tension: 53.5±3.0 dyne/cm
Molar Volume: 285.5±3.0 cm3

Click to predict properties on the Chemicalize site


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