ChemSpider 2D Image | 1-(2,4-Dichlorophenyl)-5-{[2,5-dimethyl-1-(2-methyl-4-oxo-3(4H)-quinazolinyl)-1H-pyrrol-3-yl]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione | C26H19Cl2N5O4

1-(2,4-Dichlorophenyl)-5-{[2,5-dimethyl-1-(2-methyl-4-oxo-3(4H)-quinazolinyl)-1H-pyrrol-3-yl]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione

  • Molecular FormulaC26H19Cl2N5O4
  • Average mass536.366 Da
  • Monoisotopic mass535.081421 Da
  • ChemSpider ID3150646

More details:

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

1-(2,4-Dichlorophenyl)-5-{[2,5-dimethyl-1-(2-methyl-4-oxo-3(4H)-quinazolinyl)-1H-pyrrol-3-yl]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione [ACD/IUPAC Name]
1-(2,4-Dichlorophényl)-5-{[2,5-diméthyl-1-(2-méthyl-4-oxo-3(4H)-quinazolinyl)-1H-pyrrol-3-yl]méthylène}-2,4,6(1H,3H,5H)-pyrimidinetrione [French] [ACD/IUPAC Name]
1-(2,4-Dichlorphenyl)-5-{[2,5-dimethyl-1-(2-methyl-4-oxo-3(4H)-chinazolinyl)-1H-pyrrol-3-yl]methylen}-2,4,6(1H,3H,5H)-pyrimidintrion [German] [ACD/IUPAC Name]
2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-(2,4-dichlorophenyl)-5-[[2,5-dimethyl-1-(2-methyl-4-oxo-3(4H)-quinazolinyl)-1H-pyrrol-3-yl]methylene]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.717
Molar Refractivity: 139.7±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 4.32
ACD/LogD (pH 5.5): 3.43
ACD/BCF (pH 5.5): 236.77
ACD/KOC (pH 5.5): 1735.27
ACD/LogD (pH 7.4): 3.11
ACD/BCF (pH 7.4): 112.23
ACD/KOC (pH 7.4): 822.56
Polar Surface Area: 104 Å2
Polarizability: 55.4±0.5 10-24cm3
Surface Tension: 59.1±7.0 dyne/cm
Molar Volume: 354.9±7.0 cm3

Click to predict properties on the Chemicalize site


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