ChemSpider 2D Image | Methyl N-{[6-amino-9-benzyl-2-(dimethylamino)-9H-purin-8-yl]carbonyl}glycinate | C18H21N7O3

Methyl N-{[6-amino-9-benzyl-2-(dimethylamino)-9H-purin-8-yl]carbonyl}glycinate

  • Molecular FormulaC18H21N7O3
  • Average mass383.404 Da
  • Monoisotopic mass383.170593 Da
  • ChemSpider ID30660148

More details:

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

Glycine, N-[[6-amino-2-(dimethylamino)-9-(phenylmethyl)-9H-purin-8-yl]carbonyl]-, methyl ester [ACD/Index Name]
Methyl N-{[6-amino-9-benzyl-2-(dimethylamino)-9H-purin-8-yl]carbonyl}glycinate [ACD/IUPAC Name]
Methyl-N-{[6-amino-9-benzyl-2-(dimethylamino)-9H-purin-8-yl]carbonyl}glycinat [German] [ACD/IUPAC Name]
N-{[6-Amino-9-benzyl-2-(diméthylamino)-9H-purin-8-yl]carbonyl}glycinate de méthyle [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: 1.676
Molar Refractivity: 102.4±0.5 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: -0.12
ACD/LogD (pH 5.5): 1.17
ACD/BCF (pH 5.5): 4.45
ACD/KOC (pH 5.5): 98.11
ACD/LogD (pH 7.4): 1.21
ACD/BCF (pH 7.4): 4.90
ACD/KOC (pH 7.4): 108.17
Polar Surface Area: 128 Å2
Polarizability: 40.6±0.5 10-24cm3
Surface Tension: 56.7±7.0 dyne/cm
Molar Volume: 272.4±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement