ChemSpider 2D Image | [4-(5-Methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-1-piperazinyl][3-(1-piperidinylsulfonyl)phenyl]methanone | C22H27N7O3S

[4-(5-Methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-1-piperazinyl][3-(1-piperidinylsulfonyl)phenyl]methanone

  • Molecular FormulaC22H27N7O3S
  • Average mass469.560 Da
  • Monoisotopic mass469.189606 Da
  • ChemSpider ID30521584

More details:

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

[4-(5-Methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-1-piperazinyl][3-(1-piperidinylsulfonyl)phenyl]methanon [German] [ACD/IUPAC Name]
[4-(5-Methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-1-piperazinyl][3-(1-piperidinylsulfonyl)phenyl]methanone [ACD/IUPAC Name]
[4-(5-Méthyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-1-pipérazinyl][3-(1-pipéridinylsulfonyl)phényl]méthanone [French] [ACD/IUPAC Name]
Methanone, [4-(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-1-piperazinyl][3-(1-piperidinylsulfonyl)phenyl]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.728
Molar Refractivity: 126.6±0.5 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -0.27
ACD/LogD (pH 5.5): 0.82
ACD/BCF (pH 5.5): 2.46
ACD/KOC (pH 5.5): 65.90
ACD/LogD (pH 7.4): 0.83
ACD/BCF (pH 7.4): 2.50
ACD/KOC (pH 7.4): 67.04
Polar Surface Area: 112 Å2
Polarizability: 50.2±0.5 10-24cm3
Surface Tension: 65.7±7.0 dyne/cm
Molar Volume: 317.8±7.0 cm3

Click to predict properties on the Chemicalize site


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