ChemSpider 2D Image | 1,3-Dimethyl-6-{4-[4-(4-morpholinyl)-4-oxobutanoyl]-1-piperazinyl}-2,4(1H,3H)-pyrimidinedione | C18H27N5O5

1,3-Dimethyl-6-{4-[4-(4-morpholinyl)-4-oxobutanoyl]-1-piperazinyl}-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC18H27N5O5
  • Average mass393.438 Da
  • Monoisotopic mass393.201233 Da
  • ChemSpider ID29173998

More details:

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

1,3-Dimethyl-6-{4-[4-(4-morpholinyl)-4-oxobutanoyl]-1-piperazinyl}-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
1,3-Dimethyl-6-{4-[4-(4-morpholinyl)-4-oxobutanoyl]-1-piperazinyl}-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
1,3-Diméthyl-6-{4-[4-(4-morpholinyl)-4-oxobutanoyl]-1-pipérazinyl}-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
2,4(1H,3H)-Pyrimidinedione, 1,3-dimethyl-6-[4-[4-(4-morpholinyl)-1,4-dioxobutyl]-1-piperazinyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 623.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.4±3.0 kJ/mol
Flash Point: 331.1±34.3 °C
Index of Refraction: 1.576
Molar Refractivity: 98.5±0.3 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 0.05
ACD/LogD (pH 5.5): -1.75
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.39
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.86
Polar Surface Area: 94 Å2
Polarizability: 39.0±0.5 10-24cm3
Surface Tension: 57.4±3.0 dyne/cm
Molar Volume: 297.6±3.0 cm3

Click to predict properties on the Chemicalize site


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