ChemSpider 2D Image | (5Z)-3-(4-Fluorobenzyl)-5-{[3-(4-fluorobenzyl)-5-hydroxy-1-(4-methoxyphenyl)-1H-pyrazol-4-yl]methylene}-2,4-imidazolidinedione | C28H22F2N4O4

(5Z)-3-(4-Fluorobenzyl)-5-{[3-(4-fluorobenzyl)-5-hydroxy-1-(4-methoxyphenyl)-1H-pyrazol-4-yl]methylene}-2,4-imidazolidinedione

  • Molecular FormulaC28H22F2N4O4
  • Average mass516.495 Da
  • Monoisotopic mass516.160889 Da
  • ChemSpider ID22827153

  • Double-bond stereo - Double-bond stereo

More details:

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

(5Z)-3-(4-Fluorbenzyl)-5-{[3-(4-fluorbenzyl)-5-hydroxy-1-(4-methoxyphenyl)-1H-pyrazol-4-yl]methylen}-2,4-imidazolidindion [German] [ACD/IUPAC Name]
(5Z)-3-(4-Fluorobenzyl)-5-{[3-(4-fluorobenzyl)-5-hydroxy-1-(4-methoxyphenyl)-1H-pyrazol-4-yl]methylene}-2,4-imidazolidinedione [ACD/IUPAC Name]
(5Z)-3-(4-Fluorobenzyl)-5-{[3-(4-fluorobenzyl)-5-hydroxy-1-(4-méthoxyphényl)-1H-pyrazol-4-yl]méthylène}-2,4-imidazolidinedione [French] [ACD/IUPAC Name]
2,4-Imidazolidinedione, 3-[(4-fluorophenyl)methyl]-5-[[3-[(4-fluorophenyl)methyl]-5-hydroxy-1-(4-methoxyphenyl)-1H-pyrazol-4-yl]methylene]-, (5Z)- [ACD/Index 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.649
Molar Refractivity: 136.4±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 5.84
ACD/LogD (pH 5.5): 4.44
ACD/BCF (pH 5.5): 1361.24
ACD/KOC (pH 5.5): 5905.79
ACD/LogD (pH 7.4): 3.46
ACD/BCF (pH 7.4): 141.79
ACD/KOC (pH 7.4): 615.14
Polar Surface Area: 97 Å2
Polarizability: 54.1±0.5 10-24cm3
Surface Tension: 50.6±7.0 dyne/cm
Molar Volume: 374.4±7.0 cm3

Click to predict properties on the Chemicalize site


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