ChemSpider 2D Image | 2-{[1-(2-Methoxyphenyl)ethyl]amino}-2-oxoethyl (1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetate | C20H23N5O6

2-{[1-(2-Methoxyphenyl)ethyl]amino}-2-oxoethyl (1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetate

  • Molecular FormulaC20H23N5O6
  • Average mass429.427 Da
  • Monoisotopic mass429.164825 Da
  • ChemSpider ID22767980

More details:

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

(1,3-Diméthyl-2,6-dioxo-1,2,3,6-tétrahydro-7H-purin-7-yl)acétate de 2-{[1-(2-méthoxyphényl)éthyl]amino}-2-oxoéthyle [French] [ACD/IUPAC Name]
2-{[1-(2-Methoxyphenyl)ethyl]amino}-2-oxoethyl (1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetate [ACD/IUPAC Name]
2-{[1-(2-Methoxyphenyl)ethyl]amino}-2-oxoethyl-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetat [German] [ACD/IUPAC Name]
7H-Purine-7-acetic acid, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-, 2-[[1-(2-methoxyphenyl)ethyl]amino]-2-oxoethyl ester [ACD/Index 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: 1.633
Molar Refractivity: 110.5±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 1.29
ACD/LogD (pH 5.5): 1.12
ACD/BCF (pH 5.5): 4.19
ACD/KOC (pH 5.5): 97.12
ACD/LogD (pH 7.4): 1.12
ACD/BCF (pH 7.4): 4.19
ACD/KOC (pH 7.4): 97.12
Polar Surface Area: 123 Å2
Polarizability: 43.8±0.5 10-24cm3
Surface Tension: 53.2±7.0 dyne/cm
Molar Volume: 309.2±7.0 cm3

Click to predict properties on the Chemicalize site


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