Lipophilicities of 21 newly synthesized 1,2,4-triazoles, compounds of potential importance as fungicides, have been determined by micellar and reversed-phase planar chromatography. Different stationary and mobile phases were used in the measurements. Chromatographic lipophilicities (log km and RM0) were correlated with partition coefficients log P (Alog Ps, AClog P, Alog P, Mlog P, KowWin, xlog P2 and xlog P3) calculated from molecular structures. Principal component analysis allowed a more objective comparison of different lipophilicity descriptors determined from various chromatographic systems and calculated theoretically as log P parameters.
S. Gocan, G. Cipman, J. Comer, in: E. Grushka, N. Grinberg (eds.), Advances in Chromatography, Vol. 44. Taylor & Francis Group, London, 2005.
Comer J., '', in Advances in Chromatography, Vol. 44, (2005) -.
Comer J.Advances in Chromatography, Vol. 442005)| false
R. Kaliszan, Quantitative Structure-Chromatographic Retention Relationships. John Wiley & Sons, New York, 1987.
Kaliszan R., '', in Quantitative Structure-Chromatographic Retention Relationships, (1987) -.
I.V. Tetko, J. Gasteiger, R. Todeschini, A. Mauri, D. Livingstone, P. Ertl, V.A. Palyulin, E.V. Radchenko, N.S. Zefirov, A.S. Makarenko, V.Yu. Tanchuk, V.V. Prokopenko, J. Comput. Aid Mol. Des. 19 (2005) 453–463.
Prokopenko V.V., '' (2005) 19J. Comput. Aid Mol. Des.: 453-463.
Prokopenko V.V.J. Comput. Aid Mol. Des.200519453463)| false
M. Janicka, K. Stępnik, A. Pachuta-Stec, Chromatographia 75 (2012) 449–456.
Pachuta-Stec A., '' (2012) 75Chromatographia: 449-456.