ChemSpider 2D Image | 1-[4-(Dimethylamino)-2-(4-morpholinyl)-5-pyrimidinyl]-3-[3-(trifluoromethyl)phenyl]urea | C18H21F3N6O2

1-[4-(Dimethylamino)-2-(4-morpholinyl)-5-pyrimidinyl]-3-[3-(trifluoromethyl)phenyl]urea

  • Molecular FormulaC18H21F3N6O2
  • Average mass410.393 Da
  • Monoisotopic mass410.167816 Da
  • ChemSpider ID35212862

More details:

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

1-[4-(Dimethylamino)-2-(4-morpholinyl)-5-pyrimidinyl]-3-[3-(trifluormethyl)phenyl]harnstoff [German] [ACD/IUPAC Name]
1-[4-(Dimethylamino)-2-(4-morpholinyl)-5-pyrimidinyl]-3-[3-(trifluoromethyl)phenyl]urea [ACD/IUPAC Name]
1-[4-(Diméthylamino)-2-(4-morpholinyl)-5-pyrimidinyl]-3-[3-(trifluorométhyl)phényl]urée [French] [ACD/IUPAC Name]
Urea, N-[4-(dimethylamino)-2-(4-morpholinyl)-5-pyrimidinyl]-N'-[3-(trifluoromethyl)phenyl]- [ACD/Index Name]
1-(4-(dimethylamino)-2-morpholinopyrimidin-5-yl)-3-(3-(trifluoromethyl)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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.621
Molar Refractivity: 102.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.46
ACD/LogD (pH 5.5): 1.38
ACD/BCF (pH 5.5): 1.73
ACD/KOC (pH 5.5): 10.53
ACD/LogD (pH 7.4): 2.46
ACD/BCF (pH 7.4): 20.47
ACD/KOC (pH 7.4): 124.32
Polar Surface Area: 83 Å2
Polarizability: 40.6±0.5 10-24cm3
Surface Tension: 60.7±3.0 dyne/cm
Molar Volume: 291.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement