ChemSpider 2D Image | 1-{4-[6-(Dibutylamino)-2-(2-methyl-2-propanyl)-4-pyrimidinyl]-1-piperazinyl}-3-(4-morpholinyl)-1-propanone | C27H48N6O2

1-{4-[6-(Dibutylamino)-2-(2-methyl-2-propanyl)-4-pyrimidinyl]-1-piperazinyl}-3-(4-morpholinyl)-1-propanone

  • Molecular FormulaC27H48N6O2
  • Average mass488.709 Da
  • Monoisotopic mass488.383881 Da
  • ChemSpider ID121851718

More details:

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

1-{4-[6-(Dibutylamino)-2-(2-methyl-2-propanyl)-4-pyrimidinyl]-1-piperazinyl}-3-(4-morpholinyl)-1-propanon [German] [ACD/IUPAC Name]
1-{4-[6-(Dibutylamino)-2-(2-methyl-2-propanyl)-4-pyrimidinyl]-1-piperazinyl}-3-(4-morpholinyl)-1-propanone [ACD/IUPAC Name]
1-{4-[6-(Dibutylamino)-2-(2-méthyl-2-propanyl)-4-pyrimidinyl]-1-pipérazinyl}-3-(4-morpholinyl)-1-propanone [French] [ACD/IUPAC Name]
1-Propanone, 1-[4-[6-(dibutylamino)-2-(1,1-dimethylethyl)-4-pyrimidinyl]-1-piperazinyl]-3-(4-morpholinyl)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 648.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.6±3.0 kJ/mol
Flash Point: 346.1±31.5 °C
Index of Refraction: 1.537
Molar Refractivity: 142.2±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 3.85
ACD/LogD (pH 5.5): 0.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 2.93
ACD/BCF (pH 7.4): 62.13
ACD/KOC (pH 7.4): 386.86
Polar Surface Area: 65 Å2
Polarizability: 56.4±0.5 10-24cm3
Surface Tension: 45.3±3.0 dyne/cm
Molar Volume: 455.3±3.0 cm3

Click to predict properties on the Chemicalize site


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