Prediction of octanol/water partition coefficient of selected ferrocene derivatives using rekker method

Ahmedi, R.; Lanez, Touhami

doi:10.4314/jfas.v3i2.7

Cited by 8 publications

(6 citation statements)

References 8 publications

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“…Similar results were obtained by Ahmedi and Lanez , who calculated the log P for several ferrocene‐derived compounds as being approximately 2.5 and 5.5, and Silva et al. , with very similar values.…”

Section: Resultssupporting

confidence: 86%

On the Use of Dispersive Liquid‐liquid Microextraction Combined with Organic/Water Interface Electrochemistry

et al. 2016

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In this paper, we discuss the use of dispersive liquid‐liquid microextraction (DLLME) combined with organic/water interface electrochemistry (OWIE) by using ferrocene as a model‐molecule. A mixture of 150 μL of ethanol (disperser solvent) and 50 μL of 1‐undecanol (extractant solvent) was injected into 9 mL of a ferrocene aqueous solution prepared in 1.0×10−3 mol L−1 H2SO4. Afterward, a drop of the organic phase containing ferrocene was directly inserted on a screen‐printed carbon electrode and the analytical curve was obtained, point‐to‐point, with a good linearity. Besides that, a boron‐doped diamond (BDD) electrode was used to promote the partition coefficient calculation, and it was possible to calculate the final concentrations of ferrocene in the aqueous and organic phases as being equal to 4.2×10−4 mol L−1 and 1.0×10−1 mol L−1, respectively. By using these values, the partition coefficient (log P) was calculated as 2.5±0.1 (n=3), a similar result to that obtained using other methodologies.

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Section: Resultssupporting

confidence: 86%

On the Use of Dispersive Liquid‐liquid Microextraction Combined with Organic/Water Interface Electrochemistry

et al. 2016

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“…Previously, the estimation of logP of several substituted ferrocene using three different methods, Rekker, XlogPand AlogP has been reported [6][7][8][9].…”

mentioning

confidence: 99%

Estimating octanol/water partition coefficient for selected ferrocene derivatives using XlogPv2.0 approach

Ahmedi¹,

Lanez²

2018

J. Fundam and Appl Sci.

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“…Recent studies disclosed that the cytotoxicity of polyphenol compounds has a close relationship with its lipophilicity and E 2 7 . 27,28 The log P of compound 1 is 3.18, which is higher than that of compound 4 (2.48). Higher log P or lower E 2 7 may lead to higher toxicity.…”

Section: Dalton Transactions Papermentioning

confidence: 82%

Synthesis and biological evaluation of hydroxyl-substituted Schiff-bases containing ferrocenyl moieties

Chen

Wang

et al. 2013

Dalton Trans.

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Three new hydroxyl-substituted Schiff-bases containing ferrocenyl moieties were synthesized, and their antioxidant and anticancer activities were evaluated. Among the synthesized hydroxyl-substituted Schiff-bases, compound 1 containing both ferrocenyl and o-dihydroxyl groups exhibits the highest antioxidant and anticancer activities. Flow cytometric analysis showed that compound 1 is capable of disturbing the cancer cell cycle and inducing more cells to be arrested in G2 phase. The excellent biological activities of compound 1 are attributed to the presence of both ferrocenyl and o-dihydroxyl groups. The ferrocenyl moiety has dual functions in compound 1, i.e., increasing the lipophilicity and lowering the redox potentials of o-dihydroxyl groups. In addition, compound 1 could reversibly bind with HSA mainly via a mechanism involving the formation of complexes, in which hydrophobic interaction is the main acting force. Thus, compound 1 containing both ferrocenyl and o-dihydroxyl groups is a potential antioxidant with anticancer activity.

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Prediction of octanol/water partition coefficient of selected ferrocene derivatives using rekker method

Cited by 8 publications

References 8 publications

On the Use of Dispersive Liquid‐liquid Microextraction Combined with Organic/Water Interface Electrochemistry

On the Use of Dispersive Liquid‐liquid Microextraction Combined with Organic/Water Interface Electrochemistry

Estimating octanol/water partition coefficient for selected ferrocene derivatives using XlogPv2.0 approach

Synthesis and biological evaluation of hydroxyl-substituted Schiff-bases containing ferrocenyl moieties

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