ChemSpider 2D Image | 1-(5-Chloro-2-methoxyphenyl)-3-(4-{[2-methyl-6-(4-morpholinyl)-4-pyrimidinyl]amino}phenyl)urea | C23H25ClN6O3

1-(5-Chloro-2-methoxyphenyl)-3-(4-{[2-methyl-6-(4-morpholinyl)-4-pyrimidinyl]amino}phenyl)urea

  • Molecular FormulaC23H25ClN6O3
  • Average mass468.936 Da
  • Monoisotopic mass468.167664 Da
  • ChemSpider ID29024088

More details:

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

1-(5-Chlor-2-methoxyphenyl)-3-(4-{[2-methyl-6-(4-morpholinyl)-4-pyrimidinyl]amino}phenyl)harnstoff [German] [ACD/IUPAC Name]
1-(5-Chloro-2-methoxyphenyl)-3-(4-{[2-methyl-6-(4-morpholinyl)-4-pyrimidinyl]amino}phenyl)urea [ACD/IUPAC Name]
1-(5-Chloro-2-méthoxyphényl)-3-(4-{[2-méthyl-6-(4-morpholinyl)-4-pyrimidinyl]amino}phényl)urée [French] [ACD/IUPAC Name]
Urea, N-(5-chloro-2-methoxyphenyl)-N'-[4-[[2-methyl-6-(4-morpholinyl)-4-pyrimidinyl]amino]phenyl]- [ACD/Index Name]
1-(5-CHLORO-2-METHOXYPHENYL)-3-(4-{[2-METHYL-6-(MORPHOLIN-4-YL)PYRIMIDIN-4-YL]AMINO}PHENYL)UREA

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

Density: 1.4±0.1 g/cm3
Boiling Point: 591.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.2±3.0 kJ/mol
Flash Point: 311.2±30.1 °C
Index of Refraction: 1.688
Molar Refractivity: 128.8±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.76
ACD/LogD (pH 5.5): 3.44
ACD/BCF (pH 5.5): 135.57
ACD/KOC (pH 5.5): 591.44
ACD/LogD (pH 7.4): 4.43
ACD/BCF (pH 7.4): 1319.13
ACD/KOC (pH 7.4): 5754.68
Polar Surface Area: 101 Å2
Polarizability: 51.1±0.5 10-24cm3
Surface Tension: 70.9±3.0 dyne/cm
Molar Volume: 337.9±3.0 cm3

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