ChemSpider 2D Image | 1-{2,4-Dimethyl-5-[(4-methyl-1-piperazinyl)methyl]phenyl}-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methylmethanamine | C21H33N5O

1-{2,4-Dimethyl-5-[(4-methyl-1-piperazinyl)methyl]phenyl}-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methylmethanamine

  • Molecular FormulaC21H33N5O
  • Average mass371.520 Da
  • Monoisotopic mass371.268524 Da
  • ChemSpider ID32745157

More details:

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

1,3,4-Oxadiazole-2-methanamine, N-[[2,4-dimethyl-5-[(4-methyl-1-piperazinyl)methyl]phenyl]methyl]-5-ethyl-N-methyl- [ACD/Index Name]
1-{2,4-Dimethyl-5-[(4-methyl-1-piperazinyl)methyl]phenyl}-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methylmethanamin [German] [ACD/IUPAC Name]
1-{2,4-Dimethyl-5-[(4-methyl-1-piperazinyl)methyl]phenyl}-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methylmethanamine [ACD/IUPAC Name]
1-{2,4-Diméthyl-5-[(4-méthyl-1-pipérazinyl)méthyl]phényl}-N-[(5-éthyl-1,3,4-oxadiazol-2-yl)méthyl]-N-méthylméthanamine [French] [ACD/IUPAC Name]
1-{2,4-dimethyl-5-[(4-methylpiperazin-1-yl)methyl]phenyl}-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methylmethanamine

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

Density: 1.1±0.1 g/cm3
Boiling Point: 489.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.6±3.0 kJ/mol
Flash Point: 249.8±31.5 °C
Index of Refraction: 1.560
Molar Refractivity: 109.5±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.00
ACD/LogD (pH 5.5): -0.60
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.55
ACD/BCF (pH 7.4): 6.77
ACD/KOC (pH 7.4): 99.53
Polar Surface Area: 49 Å2
Polarizability: 43.4±0.5 10-24cm3
Surface Tension: 47.0±3.0 dyne/cm
Molar Volume: 338.8±3.0 cm3

Click to predict properties on the Chemicalize site


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