ChemSpider 2D Image | N-{2-[5-(3,4-Dimethoxyphenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)cyclobutanecarboxamide | C27H32FN3O5

N-{2-[5-(3,4-Dimethoxyphenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)cyclobutanecarboxamide

  • Molecular FormulaC27H32FN3O5
  • Average mass497.559 Da
  • Monoisotopic mass497.232605 Da
  • ChemSpider ID22600883

More details:

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

Cyclobutanecarboxamide, N-[2-[5-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl]-N-(2-methoxyethyl)- [ACD/Index Name]
N-{2-[5-(3,4-Dimethoxyphenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)cyclobutanecarboxamide [ACD/IUPAC Name]
N-{2-[5-(3,4-Diméthoxyphényl)-3-(4-fluorophényl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoéthyl}-N-(2-méthoxyéthyl)cyclobutanecarboxamide [French] [ACD/IUPAC Name]
N-{2-[5-(3,4-Dimethoxyphenyl)-3-(4-fluorphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)cyclobutancarboxamid [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 632.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.5±3.0 kJ/mol
Flash Point: 336.0±34.3 °C
Index of Refraction: 1.591
Molar Refractivity: 132.9±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 2.22
ACD/LogD (pH 5.5): 2.84
ACD/BCF (pH 5.5): 85.24
ACD/KOC (pH 5.5): 838.60
ACD/LogD (pH 7.4): 2.84
ACD/BCF (pH 7.4): 85.24
ACD/KOC (pH 7.4): 838.60
Polar Surface Area: 81 Å2
Polarizability: 52.7±0.5 10-24cm3
Surface Tension: 43.9±7.0 dyne/cm
Molar Volume: 393.3±7.0 cm3

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