ChemSpider 2D Image | 2-(4-{[1-(3-Bromophenyl)cyclopropyl]carbonyl}-1-piperazinyl)-N-(4-fluorophenyl)acetamide | C22H23BrFN3O2

2-(4-{[1-(3-Bromophenyl)cyclopropyl]carbonyl}-1-piperazinyl)-N-(4-fluorophenyl)acetamide

  • Molecular FormulaC22H23BrFN3O2
  • Average mass460.339 Da
  • Monoisotopic mass459.095764 Da
  • ChemSpider ID33795311

More details:






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

1-Piperazineacetamide, 4-[[1-(3-bromophenyl)cyclopropyl]carbonyl]-N-(4-fluorophenyl)- [ACD/Index Name]
2-(4-{[1-(3-Bromophenyl)cyclopropyl]carbonyl}-1-piperazinyl)-N-(4-fluorophenyl)acetamide [ACD/IUPAC Name]
2-(4-{[1-(3-Bromophényl)cyclopropyl]carbonyl}-1-pipérazinyl)-N-(4-fluorophényl)acétamide [French] [ACD/IUPAC Name]
2-(4-{[1-(3-Bromphenyl)cyclopropyl]carbonyl}-1-piperazinyl)-N-(4-fluorphenyl)acetamid [German] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 643.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.9±3.0 kJ/mol
Flash Point: 342.7±31.5 °C
Index of Refraction: 1.645
Molar Refractivity: 112.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.34
ACD/LogD (pH 5.5): 3.58
ACD/BCF (pH 5.5): 307.50
ACD/KOC (pH 5.5): 2093.02
ACD/LogD (pH 7.4): 3.58
ACD/BCF (pH 7.4): 311.54
ACD/KOC (pH 7.4): 2120.50
Polar Surface Area: 53 Å2
Polarizability: 44.6±0.5 10-24cm3
Surface Tension: 60.1±3.0 dyne/cm
Molar Volume: 310.7±3.0 cm3

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