ChemSpider 2D Image | N-[1-(2,4-Difluorophenoxy)-2-propanyl]-3-(3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)propanamide | C18H19F2N5O4

N-[1-(2,4-Difluorophenoxy)-2-propanyl]-3-(3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)propanamide

  • Molecular FormulaC18H19F2N5O4
  • Average mass407.371 Da
  • Monoisotopic mass407.140503 Da
  • ChemSpider ID34301113

More details:

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

1H-Purine-8-propanamide, N-[2-(2,4-difluorophenoxy)-1-methylethyl]-2,3,6,7-tetrahydro-3-methyl-2,6-dioxo- [ACD/Index Name]
N-[1-(2,4-Difluorophenoxy)-2-propanyl]-3-(3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)propanamide [ACD/IUPAC Name]
N-[1-(2,4-Difluorophénoxy)-2-propanyl]-3-(3-méthyl-2,6-dioxo-2,3,6,7-tétrahydro-1H-purin-8-yl)propanamide [French] [ACD/IUPAC Name]
N-[1-(2,4-Difluorphenoxy)-2-propanyl]-3-(3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)propanamid [German] [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: 1.577
Molar Refractivity: 96.1±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: -0.42
ACD/LogD (pH 5.5): 0.94
ACD/BCF (pH 5.5): 3.03
ACD/KOC (pH 5.5): 76.88
ACD/LogD (pH 7.4): 0.94
ACD/BCF (pH 7.4): 3.03
ACD/KOC (pH 7.4): 76.87
Polar Surface Area: 116 Å2
Polarizability: 38.1±0.5 10-24cm3
Surface Tension: 56.1±3.0 dyne/cm
Molar Volume: 289.9±3.0 cm3

Click to predict properties on the Chemicalize site


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