ChemSpider 2D Image | 3-(4-Fluorobenzyl)-1,6,7-trimethyl-8-(1-phenylethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione | C25H24FN5O2

3-(4-Fluorobenzyl)-1,6,7-trimethyl-8-(1-phenylethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione

  • Molecular FormulaC25H24FN5O2
  • Average mass445.489 Da
  • Monoisotopic mass445.191406 Da
  • ChemSpider ID17919577

More details:

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

1H-Imidazo[2,1-f]purine-2,4(3H,8H)-dione, 3-[(4-fluorophenyl)methyl]-1,6,7-trimethyl-8-(1-phenylethyl)- [ACD/Index Name]
3-(4-Fluorbenzyl)-1,6,7-trimethyl-8-(1-phenylethyl)-1H-imidazo[2,1-f]purin-2,4(3H,8H)-dion [German] [ACD/IUPAC Name]
3-(4-Fluorobenzyl)-1,6,7-trimethyl-8-(1-phenylethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione [ACD/IUPAC Name]
3-(4-Fluorobenzyl)-1,6,7-triméthyl-8-(1-phényléthyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione [French] [ACD/IUPAC Name]
3-[(4-fluorophenyl)methyl]-1,6,7-trimethyl-8-(1-phenylethyl)-1H,2H,3H,4H,8H-imidazo[1,2-g]purine-2,4-dione
919012-13-8 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.670
Molar Refractivity: 124.7±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.47
ACD/LogD (pH 5.5): 2.71
ACD/BCF (pH 5.5): 18.49
ACD/KOC (pH 5.5): 60.56
ACD/LogD (pH 7.4): 4.06
ACD/BCF (pH 7.4): 412.43
ACD/KOC (pH 7.4): 1350.88
Polar Surface Area: 63 Å2
Polarizability: 49.4±0.5 10-24cm3
Surface Tension: 49.0±7.0 dyne/cm
Molar Volume: 333.9±7.0 cm3

Click to predict properties on the Chemicalize site


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