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

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

  • Molecular FormulaC23H25F4N3O3S
  • Average mass499.522 Da
  • Monoisotopic mass499.155273 Da
  • ChemSpider ID21963598

More details:

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

(3-{[4-(4-Fluorophenyl)-1-piperazinyl]sulfonyl}phenyl)[3-(trifluoromethyl)-1-piperidinyl]methanone [ACD/IUPAC Name]
(3-{[4-(4-Fluorophényl)-1-pipérazinyl]sulfonyl}phényl)[3-(trifluorométhyl)-1-pipéridinyl]méthanone [French] [ACD/IUPAC Name]
(3-{[4-(4-Fluorphenyl)-1-piperazinyl]sulfonyl}phenyl)[3-(trifluormethyl)-1-piperidinyl]methanon [German] [ACD/IUPAC Name]
Methanone, [3-[[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl]phenyl][3-(trifluoromethyl)-1-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: 629.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.2±3.0 kJ/mol
Flash Point: 334.7±34.3 °C
Index of Refraction: 1.573
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: 2.55
ACD/LogD (pH 5.5): 3.05
ACD/BCF (pH 5.5): 115.81
ACD/KOC (pH 5.5): 978.63
ACD/LogD (pH 7.4): 3.15
ACD/BCF (pH 7.4): 145.07
ACD/KOC (pH 7.4): 1225.96
Polar Surface Area: 69 Å2
Polarizability: 47.3±0.5 10-24cm3
Surface Tension: 47.3±3.0 dyne/cm
Molar Volume: 362.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement