ChemSpider 2D Image | N~5~-Benzyl-N~7~-(4-fluorobenzyl)-2-(2-furyl)[1,2,4]triazolo[1,5-a][1,3,5]triazine-5,7-diamine | C22H18FN7O

N5-Benzyl-N7-(4-fluorobenzyl)-2-(2-furyl)[1,2,4]triazolo[1,5-a][1,3,5]triazine-5,7-diamine

  • Molecular FormulaC22H18FN7O
  • Average mass415.423 Da
  • Monoisotopic mass415.155701 Da
  • ChemSpider ID58869120

More details:

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

[1,2,4]Triazolo[1,5-a][1,3,5]triazine-5,7-diamine, N7-[(4-fluorophenyl)methyl]-2-(2-furanyl)-N5-(phenylmethyl)- [ACD/Index Name]
N5-Benzyl-N7-(4-fluorbenzyl)-2-(2-furyl)[1,2,4]triazolo[1,5-a][1,3,5]triazin-5,7-diamin [German] [ACD/IUPAC Name]
N5-Benzyl-N7-(4-fluorobenzyl)-2-(2-furyl)[1,2,4]triazolo[1,5-a][1,3,5]triazine-5,7-diamine [ACD/IUPAC Name]
N5-Benzyl-N7-(4-fluorobenzyl)-2-(2-furyl)[1,2,4]triazolo[1,5-a][1,3,5]triazine-5,7-diamine [French] [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: 1.714
Molar Refractivity: 114.7±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.37
ACD/LogD (pH 5.5): 2.95
ACD/BCF (pH 5.5): 103.01
ACD/KOC (pH 5.5): 960.02
ACD/LogD (pH 7.4): 2.95
ACD/BCF (pH 7.4): 103.13
ACD/KOC (pH 7.4): 961.12
Polar Surface Area: 93 Å2
Polarizability: 45.5±0.5 10-24cm3
Surface Tension: 56.6±7.0 dyne/cm
Molar Volume: 292.3±7.0 cm3

Click to predict properties on the Chemicalize site


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