ChemSpider 2D Image | N-[4-(Difluoromethoxy)phenyl]-4-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)butanamide | C18H19F2N5O4

N-[4-(Difluoromethoxy)phenyl]-4-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)butanamide

  • Molecular FormulaC18H19F2N5O4
  • Average mass407.371 Da
  • Monoisotopic mass407.140503 Da
  • ChemSpider ID76895281

More details:

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

7H-Purine-7-butanamide, N-[4-(difluoromethoxy)phenyl]-1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo- [ACD/Index Name]
N-[4-(Difluormethoxy)phenyl]-4-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)butanamid [German] [ACD/IUPAC Name]
N-[4-(Difluoromethoxy)phenyl]-4-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)butanamide [ACD/IUPAC Name]
N-[4-(Difluorométhoxy)phényl]-4-(1,3-diméthyl-2,6-dioxo-1,2,3,6-tétrahydro-7H-purin-7-yl)butanamide [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: 1.45
ACD/LogD (pH 5.5): 1.62
ACD/BCF (pH 5.5): 9.95
ACD/KOC (pH 5.5): 180.27
ACD/LogD (pH 7.4): 1.62
ACD/BCF (pH 7.4): 9.95
ACD/KOC (pH 7.4): 180.27
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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