ChemSpider 2D Image | 2-Fluoro-N-(4-fluorobenzyl)-N-(2-{4-[6-(3-methoxyphenyl)-3-pyridazinyl]-1-piperazinyl}-2-oxoethyl)benzamide | C31H29F2N5O3

2-Fluoro-N-(4-fluorobenzyl)-N-(2-{4-[6-(3-methoxyphenyl)-3-pyridazinyl]-1-piperazinyl}-2-oxoethyl)benzamide

  • Molecular FormulaC31H29F2N5O3
  • Average mass557.591 Da
  • Monoisotopic mass557.223816 Da
  • ChemSpider ID22677939

More details:

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

2-Fluor-N-(4-fluorbenzyl)-N-(2-{4-[6-(3-methoxyphenyl)-3-pyridazinyl]-1-piperazinyl}-2-oxoethyl)benzamid [German] [ACD/IUPAC Name]
2-Fluoro-N-(4-fluorobenzyl)-N-(2-{4-[6-(3-methoxyphenyl)-3-pyridazinyl]-1-piperazinyl}-2-oxoethyl)benzamide [ACD/IUPAC Name]
2-Fluoro-N-(4-fluorobenzyl)-N-(2-{4-[6-(3-méthoxyphényl)-3-pyridazinyl]-1-pipérazinyl}-2-oxoéthyl)benzamide [French] [ACD/IUPAC Name]
Benzamide, 2-fluoro-N-[(4-fluorophenyl)methyl]-N-[2-[4-[6-(3-methoxyphenyl)-3-pyridazinyl]-1-piperazinyl]-2-oxoethyl]- [ACD/Index 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: 813.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 118.3±3.0 kJ/mol
Flash Point: 445.9±34.3 °C
Index of Refraction: 1.613
Molar Refractivity: 149.1±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 2.55
ACD/LogD (pH 5.5): 3.69
ACD/BCF (pH 5.5): 323.57
ACD/KOC (pH 5.5): 1828.80
ACD/LogD (pH 7.4): 3.95
ACD/BCF (pH 7.4): 592.94
ACD/KOC (pH 7.4): 3351.20
Polar Surface Area: 79 Å2
Polarizability: 59.1±0.5 10-24cm3
Surface Tension: 55.2±3.0 dyne/cm
Molar Volume: 428.6±3.0 cm3

Click to predict properties on the Chemicalize site


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