ChemSpider 2D Image | Methyl 1-{2-[2-hydroxy-3-(4-methyl-1-piperazinyl)propoxy]-4-methoxybenzyl}-4-piperidinecarboxylate | C23H37N3O5

Methyl 1-{2-[2-hydroxy-3-(4-methyl-1-piperazinyl)propoxy]-4-methoxybenzyl}-4-piperidinecarboxylate

  • Molecular FormulaC23H37N3O5
  • Average mass435.557 Da
  • Monoisotopic mass435.273315 Da
  • ChemSpider ID22160718

More details:

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

1-{2-[2-Hydroxy-3-(4-méthyl-1-pipérazinyl)propoxy]-4-méthoxybenzyl}-4-pipéridinecarboxylate de méthyle [French] [ACD/IUPAC Name]
4-Piperidinecarboxylic acid, 1-[[2-[2-hydroxy-3-(4-methyl-1-piperazinyl)propoxy]-4-methoxyphenyl]methyl]-, methyl ester [ACD/Index Name]
Methyl 1-{2-[2-hydroxy-3-(4-methyl-1-piperazinyl)propoxy]-4-methoxybenzyl}-4-piperidinecarboxylate [ACD/IUPAC Name]
Methyl-1-{2-[2-hydroxy-3-(4-methyl-1-piperazinyl)propoxy]-4-methoxybenzyl}-4-piperidincarboxylat [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: 569.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.9±3.0 kJ/mol
Flash Point: 298.1±30.1 °C
Index of Refraction: 1.545
Molar Refractivity: 119.2±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 0.76
ACD/LogD (pH 5.5): -2.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.51
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 19.23
Polar Surface Area: 75 Å2
Polarizability: 47.2±0.5 10-24cm3
Surface Tension: 45.8±3.0 dyne/cm
Molar Volume: 376.9±3.0 cm3

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