ChemSpider 2D Image | (5Z)-5-({4-(Cyclopropylamino)-2-[(3-fluoro-4-methylbenzyl)amino]pyrazolo[1,5-a][1,3,5]triazin-8-yl}methylene)-2,4-imidazolidinedione | C20H19FN8O2

(5Z)-5-({4-(Cyclopropylamino)-2-[(3-fluoro-4-methylbenzyl)amino]pyrazolo[1,5-a][1,3,5]triazin-8-yl}methylene)-2,4-imidazolidinedione

  • Molecular FormulaC20H19FN8O2
  • Average mass422.416 Da
  • Monoisotopic mass422.161499 Da
  • ChemSpider ID61728399

More details:






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

(5Z)-5-({4-(Cyclopropylamino)-2-[(3-fluor-4-methylbenzyl)amino]pyrazolo[1,5-a][1,3,5]triazin-8-yl}methylen)-2,4-imidazolidindion [German] [ACD/IUPAC Name]
(5Z)-5-({4-(Cyclopropylamino)-2-[(3-fluoro-4-methylbenzyl)amino]pyrazolo[1,5-a][1,3,5]triazin-8-yl}methylene)-2,4-imidazolidinedione [ACD/IUPAC Name]
(5Z)-5-({4-(Cyclopropylamino)-2-[(3-fluoro-4-méthylbenzyl)amino]pyrazolo[1,5-a][1,3,5]triazin-8-yl}méthylène)-2,4-imidazolidinedione [French] [ACD/IUPAC Name]
2,4-Imidazolidinedione, 5-[[4-(cyclopropylamino)-2-[[(3-fluoro-4-methylphenyl)methyl]amino]pyrazolo[1,5-a]-1,3,5-triazin-8-yl]methylene]-, (5Z)- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.810
Molar Refractivity: 108.7±0.5 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 1.59
ACD/LogD (pH 5.5): 1.05
ACD/BCF (pH 5.5): 3.27
ACD/KOC (pH 5.5): 70.22
ACD/LogD (pH 7.4): -0.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.29
Polar Surface Area: 125 Å2
Polarizability: 43.1±0.5 10-24cm3
Surface Tension: 70.0±7.0 dyne/cm
Molar Volume: 252.1±7.0 cm3

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