ChemSpider 2D Image | N-[2-(4-{[1-(3-Chlorophenyl)-5-methyl-1H-pyrazol-4-yl]carbonyl}-1-piperazinyl)ethyl]-2-fluorobenzamide | C24H25ClFN5O2

N-[2-(4-{[1-(3-Chlorophenyl)-5-methyl-1H-pyrazol-4-yl]carbonyl}-1-piperazinyl)ethyl]-2-fluorobenzamide

  • Molecular FormulaC24H25ClFN5O2
  • Average mass469.939 Da
  • Monoisotopic mass469.168091 Da
  • ChemSpider ID35278446

More details:

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

Benzamide, N-[2-[4-[[1-(3-chlorophenyl)-5-methyl-1H-pyrazol-4-yl]carbonyl]-1-piperazinyl]ethyl]-2-fluoro- [ACD/Index Name]
N-[2-(4-{[1-(3-Chlorophenyl)-5-methyl-1H-pyrazol-4-yl]carbonyl}-1-piperazinyl)ethyl]-2-fluorobenzamide [ACD/IUPAC Name]
N-[2-(4-{[1-(3-Chlorophényl)-5-méthyl-1H-pyrazol-4-yl]carbonyl}-1-pipérazinyl)éthyl]-2-fluorobenzamide [French] [ACD/IUPAC Name]
N-[2-(4-{[1-(3-Chlorphenyl)-5-methyl-1H-pyrazol-4-yl]carbonyl}-1-piperazinyl)ethyl]-2-fluorbenzamid [German] [ACD/IUPAC Name]
N-(2-{4-[1-(3-CHLOROPHENYL)-5-METHYL-1H-PYRAZOLE-4-CARBONYL]PIPERAZIN-1-YL}ETHYL)-2-FLUOROBENZAMIDE
N-(2-{4-[1-(3-CHLOROPHENYL)-5-METHYLPYRAZOLE-4-CARBONYL]PIPERAZIN-1-YL}ETHYL)-2-FLUOROBENZAMIDE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 676.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.3±3.0 kJ/mol
Flash Point: 362.6±31.5 °C
Index of Refraction: 1.640
Molar Refractivity: 126.9±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.76
ACD/LogD (pH 5.5): 1.55
ACD/BCF (pH 5.5): 5.71
ACD/KOC (pH 5.5): 71.04
ACD/LogD (pH 7.4): 2.34
ACD/BCF (pH 7.4): 34.85
ACD/KOC (pH 7.4): 433.67
Polar Surface Area: 70 Å2
Polarizability: 50.3±0.5 10-24cm3
Surface Tension: 50.0±7.0 dyne/cm
Molar Volume: 352.2±7.0 cm3

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