ChemSpider 2D Image | 1-(2,4-Difluorophenyl)-3-{[4-(4-morpholinyl)-2-pyrimidinyl]methyl}urea | C16H17F2N5O2

1-(2,4-Difluorophenyl)-3-{[4-(4-morpholinyl)-2-pyrimidinyl]methyl}urea

  • Molecular FormulaC16H17F2N5O2
  • Average mass349.335 Da
  • Monoisotopic mass349.135040 Da
  • ChemSpider ID30761154

More details:

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

1-(2,4-Difluorophenyl)-3-{[4-(4-morpholinyl)-2-pyrimidinyl]methyl}urea [ACD/IUPAC Name]
1-(2,4-Difluorophényl)-3-{[4-(4-morpholinyl)-2-pyrimidinyl]méthyl}urée [French] [ACD/IUPAC Name]
1-(2,4-Difluorphenyl)-3-{[4-(4-morpholinyl)-2-pyrimidinyl]methyl}harnstoff [German] [ACD/IUPAC Name]
Urea, N-(2,4-difluorophenyl)-N'-[[4-(4-morpholinyl)-2-pyrimidinyl]methyl]- [ACD/Index Name]
1-(2,4-difluorophenyl)-3-((4-morpholinopyrimidin-2-yl)methyl)urea
1-(2,4-difluorophenyl)-3-{[4-(morpholin-4-yl)pyrimidin-2-yl]methyl}urea
1797619-21-6 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 478.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.2±3.0 kJ/mol
Flash Point: 242.9±28.7 °C
Index of Refraction: 1.609
Molar Refractivity: 86.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.57
ACD/LogD (pH 5.5): 0.44
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 16.37
ACD/LogD (pH 7.4): 1.28
ACD/BCF (pH 7.4): 5.44
ACD/KOC (pH 7.4): 114.03
Polar Surface Area: 79 Å2
Polarizability: 34.3±0.5 10-24cm3
Surface Tension: 61.5±3.0 dyne/cm
Molar Volume: 250.2±3.0 cm3

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