ChemSpider 2D Image | N-(4-Fluorophenyl)-2-{5-methyl-3-[(4-methyl-1-piperazinyl)carbonyl]-1H-pyrazol-1-yl}acetamide | C18H22FN5O2

N-(4-Fluorophenyl)-2-{5-methyl-3-[(4-methyl-1-piperazinyl)carbonyl]-1H-pyrazol-1-yl}acetamide

  • Molecular FormulaC18H22FN5O2
  • Average mass359.398 Da
  • Monoisotopic mass359.175751 Da
  • ChemSpider ID21935367

More details:

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

1H-Pyrazole-1-acetamide, N-(4-fluorophenyl)-5-methyl-3-[(4-methyl-1-piperazinyl)carbonyl]- [ACD/Index Name]
N-(4-Fluorophenyl)-2-{5-methyl-3-[(4-methyl-1-piperazinyl)carbonyl]-1H-pyrazol-1-yl}acetamide [ACD/IUPAC Name]
N-(4-Fluorophényl)-2-{5-méthyl-3-[(4-méthyl-1-pipérazinyl)carbonyl]-1H-pyrazol-1-yl}acétamide [French] [ACD/IUPAC Name]
N-(4-Fluorphenyl)-2-{5-methyl-3-[(4-methyl-1-piperazinyl)carbonyl]-1H-pyrazol-1-yl}acetamid [German] [ACD/IUPAC Name]
1172446-35-3 [RN]
N-(4-fluorophenyl)-2-(5-methyl-3-(4-methylpiperazine-1-carbonyl)-1H-pyrazol-1-yl)acetamide
N-(4-fluorophenyl)-2-[5-methyl-3-(4-methylpiperazine-1-carbonyl)-1H-pyrazol-1-yl]acetamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 595.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.7±3.0 kJ/mol
Flash Point: 313.6±30.1 °C
Index of Refraction: 1.626
Molar Refractivity: 97.0±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.05
ACD/LogD (pH 5.5): -0.72
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.16
ACD/LogD (pH 7.4): 0.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 32.38
Polar Surface Area: 70 Å2
Polarizability: 38.5±0.5 10-24cm3
Surface Tension: 48.4±7.0 dyne/cm
Molar Volume: 274.3±7.0 cm3

Click to predict properties on the Chemicalize site


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