ChemSpider 2D Image | Methyl 4-{[(2-{4-[(4-chlorophenyl)(phenyl)methyl]-1-piperazinyl}ethoxy)acetyl]amino}butanoate | C26H34ClN3O4

Methyl 4-{[(2-{4-[(4-chlorophenyl)(phenyl)methyl]-1-piperazinyl}ethoxy)acetyl]amino}butanoate

  • Molecular FormulaC26H34ClN3O4
  • Average mass488.019 Da
  • Monoisotopic mass487.223785 Da
  • ChemSpider ID30080268

More details:

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

4-{[2-(2-{4-[(4-Chlorophényl)(phényl)méthyl]-1-pipérazinyl}éthoxy)acétyl]amino}butanoate de méthyle [French] [ACD/IUPAC Name]
Butanoic acid, 4-[[2-[2-[4-[(4-chlorophenyl)phenylmethyl]-1-piperazinyl]ethoxy]acetyl]amino]-, methyl ester [ACD/Index Name]
Methyl 4-{[(2-{4-[(4-chlorophenyl)(phenyl)methyl]-1-piperazinyl}ethoxy)acetyl]amino}butanoate [ACD/IUPAC Name]
Methyl-4-{[(2-{4-[(4-chlorphenyl)(phenyl)methyl]-1-piperazinyl}ethoxy)acetyl]amino}butanoat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 630.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.3±3.0 kJ/mol
Flash Point: 335.3±31.5 °C
Index of Refraction: 1.559
Molar Refractivity: 132.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 0
ACD/LogP: 2.40
ACD/LogD (pH 5.5): 1.72
ACD/BCF (pH 5.5): 6.38
ACD/KOC (pH 5.5): 62.83
ACD/LogD (pH 7.4): 2.78
ACD/BCF (pH 7.4): 73.62
ACD/KOC (pH 7.4): 724.47
Polar Surface Area: 71 Å2
Polarizability: 52.7±0.5 10-24cm3
Surface Tension: 46.7±3.0 dyne/cm
Molar Volume: 411.6±3.0 cm3

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