ChemSpider 2D Image | 3-Amino-5-[(2-{[2-methyl-2-(4-morpholinyl)propyl]amino}-6-[4-(trifluoromethyl)phenyl]-4-pyrimidinyl)oxy]-2(1H)-quinoxalinone | C27H28F3N7O3

3-Amino-5-[(2-{[2-methyl-2-(4-morpholinyl)propyl]amino}-6-[4-(trifluoromethyl)phenyl]-4-pyrimidinyl)oxy]-2(1H)-quinoxalinone

  • Molecular FormulaC27H28F3N7O3
  • Average mass555.552 Da
  • Monoisotopic mass555.220581 Da
  • ChemSpider ID9874380

More details:

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

2(1H)-Quinoxalinone, 3-amino-5-[[2-[[2-methyl-2-(4-morpholinyl)propyl]amino]-6-[4-(trifluoromethyl)phenyl]-4-pyrimidinyl]oxy]- [ACD/Index Name]
3-Amino-5-[(2-{[2-methyl-2-(4-morpholinyl)propyl]amino}-6-[4-(trifluormethyl)phenyl]-4-pyrimidinyl)oxy]-2(1H)-chinoxalinon [German] [ACD/IUPAC Name]
3-Amino-5-[(2-{[2-methyl-2-(4-morpholinyl)propyl]amino}-6-[4-(trifluoromethyl)phenyl]-4-pyrimidinyl)oxy]-2(1H)-quinoxalinone [ACD/IUPAC Name]
3-Amino-5-[(2-{[2-méthyl-2-(4-morpholinyl)propyl]amino}-6-[4-(trifluorométhyl)phényl]-4-pyrimidinyl)oxy]-2(1H)-quinoxalinone [French] [ACD/IUPAC 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: 1.648
Molar Refractivity: 139.3±0.5 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 3.38
ACD/LogD (pH 5.5): 2.12
ACD/BCF (pH 5.5): 11.69
ACD/KOC (pH 5.5): 86.73
ACD/LogD (pH 7.4): 3.30
ACD/BCF (pH 7.4): 176.80
ACD/KOC (pH 7.4): 1311.34
Polar Surface Area: 127 Å2
Polarizability: 55.2±0.5 10-24cm3
Surface Tension: 50.8±7.0 dyne/cm
Molar Volume: 383.0±7.0 cm3

Click to predict properties on the Chemicalize site


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