ChemSpider 2D Image | N-(3-{[(4-Bromophenyl)acetyl]amino}propyl)-4-(2-fluorophenyl)-1-piperazinecarboxamide | C22H26BrFN4O2

N-(3-{[(4-Bromophenyl)acetyl]amino}propyl)-4-(2-fluorophenyl)-1-piperazinecarboxamide

  • Molecular FormulaC22H26BrFN4O2
  • Average mass477.370 Da
  • Monoisotopic mass476.122314 Da
  • ChemSpider ID59596226

More details:

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

1-Piperazinecarboxamide, N-[3-[[2-(4-bromophenyl)acetyl]amino]propyl]-4-(2-fluorophenyl)- [ACD/Index Name]
N-(3-{[(4-Bromophenyl)acetyl]amino}propyl)-4-(2-fluorophenyl)-1-piperazinecarboxamide [ACD/IUPAC Name]
N-(3-{[(4-Bromphenyl)acetyl]amino}propyl)-4-(2-fluorphenyl)-1-piperazincarboxamid [German] [ACD/IUPAC Name]
N-(3-{[2-(4-Bromophényl)acétyl]amino}propyl)-4-(2-fluorophényl)-1-pipérazinecarboxamide [French] [ACD/IUPAC 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: 729.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.4±3.0 kJ/mol
Flash Point: 394.8±32.9 °C
Index of Refraction: 1.593
Molar Refractivity: 117.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.98
ACD/LogD (pH 5.5): 3.42
ACD/BCF (pH 5.5): 235.38
ACD/KOC (pH 5.5): 1734.58
ACD/LogD (pH 7.4): 3.42
ACD/BCF (pH 7.4): 235.60
ACD/KOC (pH 7.4): 1736.23
Polar Surface Area: 65 Å2
Polarizability: 46.4±0.5 10-24cm3
Surface Tension: 51.5±3.0 dyne/cm
Molar Volume: 345.9±3.0 cm3

Click to predict properties on the Chemicalize site


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