ChemSpider 2D Image | 3-(4-{2-[Bis(4-fluorophenyl)methoxy]ethyl}-1-piperazinyl)-1-phenyl-1-propanone | C28H30F2N2O2

3-(4-{2-[Bis(4-fluorophenyl)methoxy]ethyl}-1-piperazinyl)-1-phenyl-1-propanone

  • Molecular FormulaC28H30F2N2O2
  • Average mass464.547 Da
  • Monoisotopic mass464.227539 Da
  • ChemSpider ID13469107

More details:

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

1-Propanone, 3-[4-[2-[bis(4-fluorophenyl)methoxy]ethyl]-1-piperazinyl]-1-phenyl- [ACD/Index Name]
3-(4-{2-[Bis(4-fluorophenyl)methoxy]ethyl}-1-piperazinyl)-1-phenyl-1-propanone [ACD/IUPAC Name]
3-(4-{2-[Bis(4-fluorophényl)méthoxy]éthyl}-1-pipérazinyl)-1-phényl-1-propanone [French] [ACD/IUPAC Name]
3-(4-{2-[bis(4-fluorophenyl)methoxy]ethyl}piperazin-1-yl)-1-phenylpropan-1-one
3-(4-{2-[Bis(4-fluorphenyl)methoxy]ethyl}-1-piperazinyl)-1-phenyl-1-propanon [German] [ACD/IUPAC Name]
1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-(3-oxo-3-phenylpropyl)piperazine
3-(4-{2-[Bis-(4-fluoro-phenyl)-methoxy]-ethyl}-piperazin-1-yl)-1-phenyl-propan-1-one
89769-77-7 [RN]
GBR 12935 Analogue, 11
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL283662/

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 571.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.7±3.0 kJ/mol
Flash Point: 299.4±30.1 °C
Index of Refraction: 1.566
Molar Refractivity: 129.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 4.41
ACD/LogD (pH 5.5): 3.22
ACD/BCF (pH 5.5): 70.97
ACD/KOC (pH 5.5): 269.14
ACD/LogD (pH 7.4): 4.60
ACD/BCF (pH 7.4): 1705.91
ACD/KOC (pH 7.4): 6469.25
Polar Surface Area: 33 Å2
Polarizability: 51.2±0.5 10-24cm3
Surface Tension: 43.1±3.0 dyne/cm
Molar Volume: 395.5±3.0 cm3

Click to predict properties on the Chemicalize site


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