ChemSpider 2D Image | N-{2-[2-(Difluoromethoxy)phenyl]ethyl}-2-(3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-1-yl)acetamide | C18H19F2N5O4

N-{2-[2-(Difluoromethoxy)phenyl]ethyl}-2-(3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-1-yl)acetamide

  • Molecular FormulaC18H19F2N5O4
  • Average mass407.371 Da
  • Monoisotopic mass407.140503 Da
  • ChemSpider ID48182359

More details:

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

1H-Purine-1-acetamide, N-[2-[2-(difluoromethoxy)phenyl]ethyl]-2,3,6,7-tetrahydro-3,7-dimethyl-2,6-dioxo- [ACD/Index Name]
N-{2-[2-(Difluormethoxy)phenyl]ethyl}-2-(3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-1-yl)acetamid [German] [ACD/IUPAC Name]
N-{2-[2-(Difluoromethoxy)phenyl]ethyl}-2-(3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-1-yl)acetamide [ACD/IUPAC Name]
N-{2-[2-(Difluorométhoxy)phényl]éthyl}-2-(3,7-diméthyl-2,6-dioxo-2,3,6,7-tétrahydro-1H-purin-1-yl)acétamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.624
Molar Refractivity: 99.1±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.01
ACD/LogD (pH 5.5): 1.18
ACD/BCF (pH 5.5): 4.61
ACD/KOC (pH 5.5): 103.90
ACD/LogD (pH 7.4): 1.18
ACD/BCF (pH 7.4): 4.61
ACD/KOC (pH 7.4): 103.90
Polar Surface Area: 97 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 50.4±7.0 dyne/cm
Molar Volume: 280.9±7.0 cm3

Click to predict properties on the Chemicalize site


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