ChemSpider 2D Image | 1-(4-Ethyl-1-piperazinyl)-3-(3-{[methyl(2-pyrazinylmethyl)amino]methyl}phenoxy)-2-propanol | C22H33N5O2

1-(4-Ethyl-1-piperazinyl)-3-(3-{[methyl(2-pyrazinylmethyl)amino]methyl}phenoxy)-2-propanol

  • Molecular FormulaC22H33N5O2
  • Average mass399.530 Da
  • Monoisotopic mass399.263428 Da
  • ChemSpider ID22154337

More details:






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

1-(4-Ethyl-1-piperazinyl)-3-(3-{[methyl(2-pyrazinylmethyl)amino]methyl}phenoxy)-2-propanol [ACD/IUPAC Name]
1-(4-Ethyl-1-piperazinyl)-3-(3-{[methyl(2-pyrazinylmethyl)amino]methyl}phenoxy)-2-propanol [German] [ACD/IUPAC Name]
1-(4-Éthyl-1-pipérazinyl)-3-(3-{[méthyl(2-pyrazinylméthyl)amino]méthyl}phénoxy)-2-propanol [French] [ACD/IUPAC Name]
1-Piperazineethanol, 4-ethyl-α-[[3-[[methyl(2-pyrazinylmethyl)amino]methyl]phenoxy]methyl]- [ACD/Index Name]
1-(4-ETHYLPIPERAZIN-1-YL)-3-(3-{[METHYL(PYRAZIN-2-YLMETHYL)AMINO]METHYL}PHENOXY)PROPAN-2-OL
1-(4-ETHYLPIPERAZIN-1-YL)-3-[3-({METHYL[(PYRAZIN-2-YL)METHYL]AMINO}METHYL)PHENOXY]PROPAN-2-OL

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

Density: 1.1±0.1 g/cm3
Boiling Point: 560.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.7±3.0 kJ/mol
Flash Point: 292.9±30.1 °C
Index of Refraction: 1.572
Molar Refractivity: 115.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 0.82
ACD/LogD (pH 5.5): -1.60
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.89
ACD/BCF (pH 7.4): 2.05
ACD/KOC (pH 7.4): 40.00
Polar Surface Area: 65 Å2
Polarizability: 45.7±0.5 10-24cm3
Surface Tension: 50.2±3.0 dyne/cm
Molar Volume: 350.2±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement