ChemSpider 2D Image | Methyl 3-{1-benzyl-4-[4-(2-methoxyphenyl)-1-piperazinyl]-3-piperidinyl}propanoate | C27H37N3O3

Methyl 3-{1-benzyl-4-[4-(2-methoxyphenyl)-1-piperazinyl]-3-piperidinyl}propanoate

  • Molecular FormulaC27H37N3O3
  • Average mass451.601 Da
  • Monoisotopic mass451.283478 Da
  • ChemSpider ID25071265

More details:

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

3-{1-Benzyl-4-[4-(2-méthoxyphényl)-1-pipérazinyl]-3-pipéridinyl}propanoate de méthyle [French] [ACD/IUPAC Name]
3-Piperidinepropanoic acid, 4-[4-(2-methoxyphenyl)-1-piperazinyl]-1-(phenylmethyl)-, methyl ester [ACD/Index Name]
Methyl 3-{1-benzyl-4-[4-(2-methoxyphenyl)-1-piperazinyl]-3-piperidinyl}propanoate [ACD/IUPAC Name]
Methyl-3-{1-benzyl-4-[4-(2-methoxyphenyl)-1-piperazinyl]-3-piperidinyl}propanoat [German] [ACD/IUPAC Name]
1134331-51-3 [RN]
3-piperidinepropanoic acid, 4-[4-(2-methoxyphenyl)-1-piperazinyl]-1-(phenylmethyl), methyl ester
methyl 3-(1-benzyl-4-(4-(2-methoxyphenyl)piperazin-1-yl)piperidin-3-yl)propanoate
methyl 3-[1-benzyl-4-[4-(2-methoxyphenyl)piperazin-1-yl]piperidin-3-yl]propanoate
methyl 3-{1-benzyl-4-[4-(2-methoxyphenyl)piperazin-1-yl]piperidin-3-yl}propanoate
Methyl 3-{1-benzyl-4-[4-(2-methoxyphenyl)-piperazin-1-yl]piperidin-3-yl}propanoate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 560.4±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 84.3±3.0 kJ/mol
    Flash Point: 292.7±30.1 °C
    Index of Refraction: 1.568
    Molar Refractivity: 130.9±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 0
    ACD/LogP: 4.09
    ACD/LogD (pH 5.5): 0.71
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.02
    ACD/LogD (pH 7.4): 3.38
    ACD/BCF (pH 7.4): 114.01
    ACD/KOC (pH 7.4): 476.66
    Polar Surface Area: 45 Å2
    Polarizability: 51.9±0.5 10-24cm3
    Surface Tension: 45.3±3.0 dyne/cm
    Molar Volume: 400.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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