ChemSpider 2D Image | 2-Amino-5-(1,3-benzodioxol-5-ylmethyl)[1,2,4]triazolo[1,5-c]quinazoline-8-sulfonamide | C17H14N6O4S

2-Amino-5-(1,3-benzodioxol-5-ylmethyl)[1,2,4]triazolo[1,5-c]quinazoline-8-sulfonamide

  • Molecular FormulaC17H14N6O4S
  • Average mass398.396 Da
  • Monoisotopic mass398.079712 Da
  • ChemSpider ID35034541

More details:






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

[1,2,4]Triazolo[1,5-c]quinazoline-8-sulfonamide, 2-amino-5-(1,3-benzodioxol-5-ylmethyl)- [ACD/Index Name]
2-Amino-5-(1,3-benzodioxol-5-ylmethyl)[1,2,4]triazolo[1,5-c]chinazolin-8-sulfonamid [German] [ACD/IUPAC Name]
2-Amino-5-(1,3-benzodioxol-5-ylmethyl)[1,2,4]triazolo[1,5-c]quinazoline-8-sulfonamide [ACD/IUPAC Name]
2-Amino-5-(1,3-benzodioxol-5-ylméthyl)[1,2,4]triazolo[1,5-c]quinazoline-8-sulfonamide [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.868
Molar Refractivity: 97.6±0.5 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 0.53
ACD/LogD (pH 5.5): 0.86
ACD/BCF (pH 5.5): 2.65
ACD/KOC (pH 5.5): 69.86
ACD/LogD (pH 7.4): 0.85
ACD/BCF (pH 7.4): 2.61
ACD/KOC (pH 7.4): 68.81
Polar Surface Area: 156 Å2
Polarizability: 38.7±0.5 10-24cm3
Surface Tension: 90.4±7.0 dyne/cm
Molar Volume: 215.3±7.0 cm3

Click to predict properties on the Chemicalize site






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