ChemSpider 2D Image | Raloxifene N-Oxide | C28H27NO5S

Raloxifene N-Oxide

  • Molecular FormulaC28H27NO5S
  • Average mass489.583 Da
  • Monoisotopic mass489.160980 Da
  • ChemSpider ID13975010

More details:

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

[6-Hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]{4-[2-(1-oxido-1-piperidinyl)ethoxy]phenyl}methanon [German] [ACD/IUPAC Name]
[6-Hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]{4-[2-(1-oxido-1-piperidinyl)ethoxy]phenyl}methanone [ACD/IUPAC Name]
[6-Hydroxy-2-(4-hydroxyphényl)-1-benzothiophén-3-yl]{4-[2-(1-oxydo-1-pipéridinyl)éthoxy]phényl}méthanone [French] [ACD/IUPAC Name]
195454-31-0 [RN]
Methanone, [6-hydroxy-2-(4-hydroxyphenyl)benzo[b]thien-3-yl][4-[2-(1-oxido-1-piperidinyl)ethoxy]phenyl]- [ACD/Index Name]
Raloxifene N-Oxide
[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-[4-[2-(1-oxidopiperidin-1-ium-1-yl)ethoxy]phenyl]methanone
[6-Hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl][4-[2-(piperidin-1-yl)ethoxy]phenyl]methanone N-Oxide
[6-Hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl][4-[2-(piperidin-1-yl)ethoxy]phenyl]methanone N-Oxide (Raloxifene N-Oxide)
[6-hydroxy-2-(4-hydroxyphenyl)-3-benzothiophenyl]-[4-[2-(1-oxido-1-piperidin-1-iumyl)ethoxy]phenyl]methanone
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

X1BRV5W297 [DBID]
UNII:X1BRV5W297 [DBID]
UNII-X1BRV5W297 [DBID]

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

    Density:
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction:
    Molar Refractivity:
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 1
    ACD/LogP: 5.30
    ACD/LogD (pH 5.5): 3.58
    ACD/BCF (pH 5.5): 292.97
    ACD/KOC (pH 5.5): 1898.73
    ACD/LogD (pH 7.4): 3.65
    ACD/BCF (pH 7.4): 346.27
    ACD/KOC (pH 7.4): 2244.13
    Polar Surface Area: 112 Å2
    Polarizability:
    Surface Tension:
    Molar Volume:

    Click to predict properties on the Chemicalize site


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