ChemSpider 2D Image | 5-(Hydroxymethyl)-8-(1H-pyrrol-2-yl)[1,2,4]triazolo[4,3-a]quinolin-1(2H)-one | C15H12N4O2

5-(Hydroxymethyl)-8-(1H-pyrrol-2-yl)[1,2,4]triazolo[4,3-a]quinolin-1(2H)-one

  • Molecular FormulaC15H12N4O2
  • Average mass280.281 Da
  • Monoisotopic mass280.096039 Da
  • ChemSpider ID28501633

More details:

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

[1,2,4]Triazolo[4,3-a]quinolin-1(2H)-one, 5-(hydroxymethyl)-8-(1H-pyrrol-2-yl)- [ACD/Index Name]
5-(Hydroxymethyl)-8-(1H-pyrrol-2-yl)[1,2,4]triazolo[4,3-a]chinolin-1(2H)-on [German] [ACD/IUPAC Name]
5-(Hydroxyméthyl)-8-(1H-pyrrol-2-yl)[1,2,4]triazolo[4,3-a]quinoléin-1(2H)-one [French] [ACD/IUPAC Name]
5-(Hydroxymethyl)-8-(1H-pyrrol-2-yl)[1,2,4]triazolo[4,3-a]quinolin-1(2H)-one [ACD/IUPAC Name]
5-(hydroxymethyl)-8-(1H-pyrrol-2-yl)-2H-[1,2,4]triazolo[4,3-a]quinolin-1-one

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.794
Molar Refractivity: 76.3±0.5 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.52
ACD/LogD (pH 5.5): 1.03
ACD/BCF (pH 5.5): 3.37
ACD/KOC (pH 5.5): 77.82
ACD/LogD (pH 7.4): -0.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.43
Polar Surface Area: 81 Å2
Polarizability: 30.2±0.5 10-24cm3
Surface Tension: 69.9±7.0 dyne/cm
Molar Volume: 179.5±7.0 cm3

Click to predict properties on the Chemicalize site


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