ChemSpider 2D Image | 2-(8-Chloro-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-{[5-(4-chlorophenyl)-2-furyl]methyl}acetamide | C20H17Cl2N5O4

2-(8-Chloro-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-{[5-(4-chlorophenyl)-2-furyl]methyl}acetamide

  • Molecular FormulaC20H17Cl2N5O4
  • Average mass462.286 Da
  • Monoisotopic mass461.065765 Da
  • ChemSpider ID22014047

More details:

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

2-(8-Chlor-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-{[5-(4-chlorphenyl)-2-furyl]methyl}acetamid [German] [ACD/IUPAC Name]
2-(8-Chloro-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-{[5-(4-chlorophenyl)-2-furyl]methyl}acetamide [ACD/IUPAC Name]
2-(8-Chloro-1,3-diméthyl-2,6-dioxo-1,2,3,6-tétrahydro-7H-purin-7-yl)-N-{[5-(4-chlorophényl)-2-furyl]méthyl}acétamide [French] [ACD/IUPAC Name]
7H-Purine-7-acetamide, 8-chloro-N-[[5-(4-chlorophenyl)-2-furanyl]methyl]-1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.703
Molar Refractivity: 115.3±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.60
ACD/LogD (pH 5.5): 3.05
ACD/BCF (pH 5.5): 122.19
ACD/KOC (pH 5.5): 1085.19
ACD/LogD (pH 7.4): 3.05
ACD/BCF (pH 7.4): 122.19
ACD/KOC (pH 7.4): 1085.18
Polar Surface Area: 101 Å2
Polarizability: 45.7±0.5 10-24cm3
Surface Tension: 60.2±7.0 dyne/cm
Molar Volume: 297.3±7.0 cm3

Click to predict properties on the Chemicalize site


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