ChemSpider 2D Image | 2-[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)(ethyl)amino]-2-oxoethyl 5-methyl-2-pyrazinecarboxylate | C21H22N6O5

2-[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)(ethyl)amino]-2-oxoethyl 5-methyl-2-pyrazinecarboxylate

  • Molecular FormulaC21H22N6O5
  • Average mass438.437 Da
  • Monoisotopic mass438.165161 Da
  • ChemSpider ID22409611

More details:

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

2-[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)(ethyl)amino]-2-oxoethyl 5-methyl-2-pyrazinecarboxylate [ACD/IUPAC Name]
2-[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)(ethyl)amino]-2-oxoethyl-5-methyl-2-pyrazincarboxylat [German] [ACD/IUPAC Name]
2-Pyrazinecarboxylic acid, 5-methyl-, 2-[[6-amino-1,2,3,4-tetrahydro-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]ethylamino]-2-oxoethyl ester [ACD/Index Name]
5-Méthyl-2-pyrazinecarboxylate de 2-[(6-amino-1-benzyl-2,4-dioxo-1,2,3,4-tétrahydro-5-pyrimidinyl)(éthyl)amino]-2-oxoéthyle [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.656
Molar Refractivity: 112.6±0.4 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: -1.74
ACD/LogD (pH 5.5): 0.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 28.07
ACD/LogD (pH 7.4): 0.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 26.53
Polar Surface Area: 148 Å2
Polarizability: 44.7±0.5 10-24cm3
Surface Tension: 77.6±5.0 dyne/cm
Molar Volume: 306.6±5.0 cm3

Click to predict properties on the Chemicalize site


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