ChemSpider 2D Image | 2-{4-[(2-Butyl-1H-imidazol-4-yl)methyl]-1-[(6-methyl-2-pyridinyl)methyl]-2-piperazinyl}ethanol | C21H33N5O

2-{4-[(2-Butyl-1H-imidazol-4-yl)methyl]-1-[(6-methyl-2-pyridinyl)methyl]-2-piperazinyl}ethanol

  • Molecular FormulaC21H33N5O
  • Average mass371.520 Da
  • Monoisotopic mass371.268524 Da
  • ChemSpider ID23047071

More details:

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

2-{4-[(2-Butyl-1H-imidazol-4-yl)methyl]-1-[(6-methyl-2-pyridinyl)methyl]-2-piperazinyl}ethanol [ACD/IUPAC Name]
2-{4-[(2-Butyl-1H-imidazol-4-yl)methyl]-1-[(6-methyl-2-pyridinyl)methyl]-2-piperazinyl}ethanol [German] [ACD/IUPAC Name]
2-{4-[(2-Butyl-1H-imidazol-4-yl)méthyl]-1-[(6-méthyl-2-pyridinyl)méthyl]-2-pipérazinyl}éthanol [French] [ACD/IUPAC Name]
2-Piperazineethanol, 4-[(2-butyl-1H-imidazol-4-yl)methyl]-1-[(6-methyl-2-pyridinyl)methyl]- [ACD/Index Name]
2-{4-[(2-BUTYL-1H-IMIDAZOL-4-YL)METHYL]-1-[(6-METHYLPYRIDIN-2-YL)METHYL]PIPERAZIN-2-YL}ETHAN-1-OL
2-{4-[(2-BUTYL-1H-IMIDAZOL-4-YL)METHYL]-1-[(6-METHYLPYRIDIN-2-YL)METHYL]PIPERAZIN-2-YL}ETHANOL

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

Density: 1.1±0.1 g/cm3
Boiling Point: 566.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.5±3.0 kJ/mol
Flash Point: 296.4±28.7 °C
Index of Refraction: 1.581
Molar Refractivity: 109.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: -0.09
ACD/LogD (pH 5.5): -1.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 15.76
Polar Surface Area: 68 Å2
Polarizability: 43.2±0.5 10-24cm3
Surface Tension: 53.7±3.0 dyne/cm
Molar Volume: 327.1±3.0 cm3

Click to predict properties on the Chemicalize site


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