ChemSpider 2D Image | [4-(4-Fluorophenyl)-1-piperazinyl](1-{[3-(trifluoromethyl)phenyl]sulfonyl}-4-piperidinyl)methanone | C23H25F4N3O3S

[4-(4-Fluorophenyl)-1-piperazinyl](1-{[3-(trifluoromethyl)phenyl]sulfonyl}-4-piperidinyl)methanone

  • Molecular FormulaC23H25F4N3O3S
  • Average mass499.522 Da
  • Monoisotopic mass499.155273 Da
  • ChemSpider ID22463523

More details:

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

[4-(4-Fluorophenyl)-1-piperazinyl](1-{[3-(trifluoromethyl)phenyl]sulfonyl}-4-piperidinyl)methanone [ACD/IUPAC Name]
[4-(4-Fluorophényl)-1-pipérazinyl](1-{[3-(trifluorométhyl)phényl]sulfonyl}-4-pipéridinyl)méthanone [French] [ACD/IUPAC Name]
[4-(4-Fluorphenyl)-1-piperazinyl](1-{[3-(trifluormethyl)phenyl]sulfonyl}-4-piperidinyl)methanon [German] [ACD/IUPAC Name]
Methanone, [4-(4-fluorophenyl)-1-piperazinyl][1-[[3-(trifluoromethyl)phenyl]sulfonyl]-4-piperidinyl]- [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: 637.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.2±3.0 kJ/mol
Flash Point: 339.4±34.3 °C
Index of Refraction: 1.572
Molar Refractivity: 119.3±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.70
ACD/LogD (pH 5.5): 3.50
ACD/BCF (pH 5.5): 267.81
ACD/KOC (pH 5.5): 1900.44
ACD/LogD (pH 7.4): 3.50
ACD/BCF (pH 7.4): 269.06
ACD/KOC (pH 7.4): 1909.36
Polar Surface Area: 69 Å2
Polarizability: 47.3±0.5 10-24cm3
Surface Tension: 47.2±3.0 dyne/cm
Molar Volume: 362.6±3.0 cm3

Click to predict properties on the Chemicalize site


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