ChemSpider 2D Image | 2-(6-Amino-1-isobutyl-3-methyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)-2-oxoethyl N-methyl-N-2-pyrimidinylglycinate | C18H24N6O5

2-(6-Amino-1-isobutyl-3-methyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)-2-oxoethyl N-methyl-N-2-pyrimidinylglycinate

  • Molecular FormulaC18H24N6O5
  • Average mass404.420 Da
  • Monoisotopic mass404.180817 Da
  • ChemSpider ID22809960

More details:

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

2-(6-Amino-1-isobutyl-3-methyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)-2-oxoethyl N-methyl-N-2-pyrimidinylglycinate [ACD/IUPAC Name]
2-(6-Amino-1-isobutyl-3-methyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)-2-oxoethyl-N-methyl-N-2-pyrimidinylglycinat [German] [ACD/IUPAC Name]
Glycine, N-methyl-N-2-pyrimidinyl-, 2-[6-amino-1,2,3,4-tetrahydro-3-methyl-1-(2-methylpropyl)-2,4-dioxo-5-pyrimidinyl]-2-oxoethyl ester [ACD/Index Name]
N-Méthyl-N-2-pyrimidinylglycinate de 2-(6-amino-1-isobutyl-3-méthyl-2,4-dioxo-1,2,3,4-tétrahydro-5-pyrimidinyl)-2-oxoéthyle [French] [ACD/IUPAC 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: 564.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.8±3.0 kJ/mol
Flash Point: 295.1±32.9 °C
Index of Refraction: 1.585
Molar Refractivity: 102.6±0.3 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 1.96
ACD/LogD (pH 5.5): 0.68
ACD/BCF (pH 5.5): 1.93
ACD/KOC (pH 5.5): 55.69
ACD/LogD (pH 7.4): 0.68
ACD/BCF (pH 7.4): 1.94
ACD/KOC (pH 7.4): 55.88
Polar Surface Area: 139 Å2
Polarizability: 40.7±0.5 10-24cm3
Surface Tension: 60.7±3.0 dyne/cm
Molar Volume: 306.0±3.0 cm3

Click to predict properties on the Chemicalize site


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