ChemSpider 2D Image | 2-[4-(4-Acetylphenyl)-1-piperazinyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-2-phenylacetamide | C27H25ClF3N3O2

2-[4-(4-Acetylphenyl)-1-piperazinyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-2-phenylacetamide

  • Molecular FormulaC27H25ClF3N3O2
  • Average mass515.955 Da
  • Monoisotopic mass515.158752 Da
  • ChemSpider ID4019408

More details:

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

1-Piperazineacetamide, 4-(4-acetylphenyl)-N-[4-chloro-3-(trifluoromethyl)phenyl]-α-phenyl- [ACD/Index Name]
2-[4-(4-Acetylphenyl)-1-piperazinyl]-N-[4-chlor-3-(trifluormethyl)phenyl]-2-phenylacetamid [German] [ACD/IUPAC Name]
2-[4-(4-Acetylphenyl)-1-piperazinyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]-2-phenylacetamide [ACD/IUPAC Name]
2-[4-(4-Acétylphényl)-1-pipérazinyl]-N-[4-chloro-3-(trifluorométhyl)phényl]-2-phénylacétamide [French] [ACD/IUPAC Name]
2-[4-(4-ACETYLPHENYL)PIPERAZIN-1-YL]-N-[4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL]-2-PHENYLACETAMIDE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 663.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.5±3.0 kJ/mol
Flash Point: 354.8±31.5 °C
Index of Refraction: 1.604
Molar Refractivity: 132.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 6.70
ACD/LogD (pH 5.5): 5.45
ACD/BCF (pH 5.5): 8092.31
ACD/KOC (pH 5.5): 21745.19
ACD/LogD (pH 7.4): 5.45
ACD/BCF (pH 7.4): 8198.12
ACD/KOC (pH 7.4): 22029.53
Polar Surface Area: 53 Å2
Polarizability: 52.7±0.5 10-24cm3
Surface Tension: 50.3±3.0 dyne/cm
Molar Volume: 386.3±3.0 cm3

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