ChemSpider 2D Image | [3-(2-Chlorophenyl)-5-methyl-1,2-oxazol-4-yl]{4-[2-methyl-6-(4-morpholinyl)-4-pyrimidinyl]-1-piperazinyl}methanone | C24H27ClN6O3

[3-(2-Chlorophenyl)-5-methyl-1,2-oxazol-4-yl]{4-[2-methyl-6-(4-morpholinyl)-4-pyrimidinyl]-1-piperazinyl}methanone

  • Molecular FormulaC24H27ClN6O3
  • Average mass482.963 Da
  • Monoisotopic mass482.183319 Da
  • ChemSpider ID29425458

More details:

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

[3-(2-Chlorophenyl)-5-methyl-1,2-oxazol-4-yl]{4-[2-methyl-6-(4-morpholinyl)-4-pyrimidinyl]-1-piperazinyl}methanone [ACD/IUPAC Name]
[3-(2-Chlorophényl)-5-méthyl-1,2-oxazol-4-yl]{4-[2-méthyl-6-(4-morpholinyl)-4-pyrimidinyl]-1-pipérazinyl}méthanone [French] [ACD/IUPAC Name]
[3-(2-Chlorphenyl)-5-methyl-1,2-oxazol-4-yl]{4-[2-methyl-6-(4-morpholinyl)-4-pyrimidinyl]-1-piperazinyl}methanon [German] [ACD/IUPAC Name]
Methanone, [3-(2-chlorophenyl)-5-methyl-4-isoxazolyl][4-[2-methyl-6-(4-morpholinyl)-4-pyrimidinyl]-1-piperazinyl]- [ACD/Index Name]
4-[6-(4-{[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]carbonyl}-1-piperazinyl)-2-methyl-4-pyrimidinyl]morpholine

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

Density: 1.3±0.1 g/cm3
Boiling Point: 730.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.6±3.0 kJ/mol
Flash Point: 395.6±32.9 °C
Index of Refraction: 1.613
Molar Refractivity: 127.2±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -1.29
ACD/LogD (pH 5.5): -0.66
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 88 Å2
Polarizability: 50.4±0.5 10-24cm3
Surface Tension: 58.3±3.0 dyne/cm
Molar Volume: 365.3±3.0 cm3

Click to predict properties on the Chemicalize site


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