ChemSpider 2D Image | 1-(5-Chloro-2,4-dimethoxyphenyl)-3-(4-{[2-methyl-6-(1-pyrrolidinyl)-4-pyrimidinyl]amino}phenyl)urea | C24H27ClN6O3

1-(5-Chloro-2,4-dimethoxyphenyl)-3-(4-{[2-methyl-6-(1-pyrrolidinyl)-4-pyrimidinyl]amino}phenyl)urea

  • Molecular FormulaC24H27ClN6O3
  • Average mass482.963 Da
  • Monoisotopic mass482.183319 Da
  • ChemSpider ID29024067

More details:

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

1-(5-Chlor-2,4-dimethoxyphenyl)-3-(4-{[2-methyl-6-(1-pyrrolidinyl)-4-pyrimidinyl]amino}phenyl)harnstoff [German] [ACD/IUPAC Name]
1-(5-Chloro-2,4-dimethoxyphenyl)-3-(4-{[2-methyl-6-(1-pyrrolidinyl)-4-pyrimidinyl]amino}phenyl)urea [ACD/IUPAC Name]
1-(5-Chloro-2,4-diméthoxyphényl)-3-(4-{[2-méthyl-6-(1-pyrrolidinyl)-4-pyrimidinyl]amino}phényl)urée [French] [ACD/IUPAC Name]
Urea, N-(5-chloro-2,4-dimethoxyphenyl)-N'-[4-[[2-methyl-6-(1-pyrrolidinyl)-4-pyrimidinyl]amino]phenyl]- [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: 597.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.0±3.0 kJ/mol
Flash Point: 315.0±30.1 °C
Index of Refraction: 1.683
Molar Refractivity: 133.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.60
ACD/LogD (pH 5.5): 3.61
ACD/BCF (pH 5.5): 183.73
ACD/KOC (pH 5.5): 731.66
ACD/LogD (pH 7.4): 4.61
ACD/BCF (pH 7.4): 1813.78
ACD/KOC (pH 7.4): 7223.06
Polar Surface Area: 101 Å2
Polarizability: 53.1±0.5 10-24cm3
Surface Tension: 69.2±3.0 dyne/cm
Molar Volume: 353.1±3.0 cm3

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