ChemSpider 2D Image | {4-[2-(2,5-Dimethyl-1H-pyrrol-1-yl)ethyl]-1-piperazinyl}[3-(2-pyrazinyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanone | C23H30N8O

{4-[2-(2,5-Dimethyl-1H-pyrrol-1-yl)ethyl]-1-piperazinyl}[3-(2-pyrazinyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanone

  • Molecular FormulaC23H30N8O
  • Average mass434.537 Da
  • Monoisotopic mass434.254272 Da
  • ChemSpider ID71078599

More details:

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

{4-[2-(2,5-Dimethyl-1H-pyrrol-1-yl)ethyl]-1-piperazinyl}[3-(2-pyrazinyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanon [German] [ACD/IUPAC Name]
{4-[2-(2,5-Dimethyl-1H-pyrrol-1-yl)ethyl]-1-piperazinyl}[3-(2-pyrazinyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanone [ACD/IUPAC Name]
{4-[2-(2,5-Diméthyl-1H-pyrrol-1-yl)éthyl]-1-pipérazinyl}[3-(2-pyrazinyl)-5,6,7,8-tétrahydro[1,2,4]triazolo[4,3-a]pyridin-8-yl]méthanone [French] [ACD/IUPAC Name]
Methanone, [4-[2-(2,5-dimethyl-1H-pyrrol-1-yl)ethyl]-1-piperazinyl][5,6,7,8-tetrahydro-3-(2-pyrazinyl)-1,2,4-triazolo[4,3-a]pyridin-8-yl]- [ACD/Index Name]
{4-[2-(2,5-dimethyl-1H-pyrrol-1-yl)ethyl]piperazino}[3-(2-pyrazinyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-8-yl]methanone

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

Density: 1.4±0.1 g/cm3
Boiling Point: 713.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.2±3.0 kJ/mol
Flash Point: 385.0±35.7 °C
Index of Refraction: 1.712
Molar Refractivity: 124.3±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.81
ACD/LogD (pH 5.5): 1.54
ACD/BCF (pH 5.5): 8.09
ACD/KOC (pH 5.5): 142.55
ACD/LogD (pH 7.4): 1.67
ACD/BCF (pH 7.4): 10.90
ACD/KOC (pH 7.4): 192.17
Polar Surface Area: 85 Å2
Polarizability: 49.3±0.5 10-24cm3
Surface Tension: 57.6±7.0 dyne/cm
Molar Volume: 317.5±7.0 cm3

Click to predict properties on the Chemicalize site


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