ChemSpider 2D Image | [4-(5-Chloro-2-methylphenyl)-1-piperazinyl][1-(2-hydroxy-2-phenylethyl)-1H-1,2,3-triazol-4-yl]methanone | C22H24ClN5O2

[4-(5-Chloro-2-methylphenyl)-1-piperazinyl][1-(2-hydroxy-2-phenylethyl)-1H-1,2,3-triazol-4-yl]methanone

  • Molecular FormulaC22H24ClN5O2
  • Average mass425.911 Da
  • Monoisotopic mass425.161865 Da
  • ChemSpider ID30748040

More details:

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

[4-(5-Chlor-2-methylphenyl)-1-piperazinyl][1-(2-hydroxy-2-phenylethyl)-1H-1,2,3-triazol-4-yl]methanon [German] [ACD/IUPAC Name]
[4-(5-Chloro-2-methylphenyl)-1-piperazinyl][1-(2-hydroxy-2-phenylethyl)-1H-1,2,3-triazol-4-yl]methanone [ACD/IUPAC Name]
[4-(5-Chloro-2-méthylphényl)-1-pipérazinyl][1-(2-hydroxy-2-phényléthyl)-1H-1,2,3-triazol-4-yl]méthanone [French] [ACD/IUPAC Name]
Methanone, [4-(5-chloro-2-methylphenyl)-1-piperazinyl][1-(2-hydroxy-2-phenylethyl)-1H-1,2,3-triazol-4-yl]- [ACD/Index Name]
(4-(5-chloro-2-methylphenyl)piperazin-1-yl)(1-(2-hydroxy-2-phenylethyl)-1H-1,2,3-triazol-4-yl)methanone
1396859-27-0 [RN]
2-(4-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]carbonyl}-1H-1,2,3-triazol-1-yl)-1-phenylethanol
2-{4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-1H-1,2,3-triazol-1-yl}-1-phenylethan-1-ol

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

Density: 1.3±0.1 g/cm3
Boiling Point: 673.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.9±3.0 kJ/mol
Flash Point: 361.0±34.3 °C
Index of Refraction: 1.665
Molar Refractivity: 117.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.66
ACD/LogD (pH 5.5): 2.48
ACD/BCF (pH 5.5): 44.86
ACD/KOC (pH 5.5): 529.68
ACD/LogD (pH 7.4): 2.48
ACD/BCF (pH 7.4): 44.86
ACD/KOC (pH 7.4): 529.72
Polar Surface Area: 74 Å2
Polarizability: 46.7±0.5 10-24cm3
Surface Tension: 53.8±7.0 dyne/cm
Molar Volume: 317.3±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement