ChemSpider 2D Image | 2-{3-[4-(3-Chlorophenyl)-1-piperazinyl](~2~H_6_)propyl}[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one | C19H16D6ClN5O

2-{3-[4-(3-Chlorophenyl)-1-piperazinyl](2H6)propyl}[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one

  • Molecular FormulaC19H16D6ClN5O
  • Average mass377.901 Da
  • Monoisotopic mass377.188934 Da
  • ChemSpider ID57558407

  • Non-standard isotope - Non-standard isotope

More details:

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

1,2,4-Triazolo[4,3-a]pyridin-3(2H)-one, 2-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl-1,1,2,2,3,3-d6]- [ACD/Index Name]
2-{3-[4-(3-Chlorophenyl)-1-piperazinyl](2H6)propyl}[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one [ACD/IUPAC Name]
2-{3-[4-(3-Chlorophényl)-1-pipérazinyl](2H6)propyl}[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one [French] [ACD/IUPAC Name]
2-{3-[4-(3-Chlorphenyl)-1-piperazinyl](2H6)propyl}[1,2,4]triazolo[4,3-a]pyridin-3(2H)-on [German] [ACD/IUPAC Name]
1181578-48-2 [RN]
2-{3-[4-(3-Chlorophenyl)piperazin-1-yl](2H6)propyl}[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one

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

Density: 1.3±0.1 g/cm3
Boiling Point: 528.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.3±3.0 kJ/mol
Flash Point: 273.4±32.9 °C
Index of Refraction: 1.671
Molar Refractivity: 104.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.66
ACD/LogD (pH 5.5): 1.17
ACD/BCF (pH 5.5): 1.91
ACD/KOC (pH 5.5): 19.53
ACD/LogD (pH 7.4): 2.59
ACD/BCF (pH 7.4): 49.87
ACD/KOC (pH 7.4): 509.86
Polar Surface Area: 42 Å2
Polarizability: 41.3±0.5 10-24cm3
Surface Tension: 55.1±7.0 dyne/cm
Molar Volume: 278.8±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement