In this study, 14 newly synthesized s-triazine derivatives were investigated by means of reversed-phase thin-layer chromatography (TLC) on C-18 stationary and two different mobile phases: acetonitrile-water and methanol-water. Quantitative structure-retention relationship (QSRR) was developed for a series of s-triazine compounds by the multiple linear regression (MLR) analysis. An MLR procedure was used to model the relation-ships between molecular descriptors and retention of s-triazine derivatives. Physico-chemical molecular descriptors were calculated from the optimized structures. Statistically significant and physically meaningful QSRRs were obtained.
Keywords:
Lipophilicity / Multiple linear regression / s-triazine
TY - JOUR
AU - Jevrić, Lidija R.
AU - Koprivica, Gordana B.
AU - Mišljenović, Nevena M.
AU - Tepić, Aleksandra N.
AU - Kuljanin, Tatjana A.
AU - Jovanović, Bratislav Ž.
PY - 2011
UR - http://TechnoRep.tmf.bg.ac.rs/handle/123456789/5642
AB - In this study, 14 newly synthesized s-triazine derivatives were investigated by means of reversed-phase thin-layer chromatography (TLC) on C-18 stationary and two different mobile phases: acetonitrile-water and methanol-water. Quantitative structure-retention relationship (QSRR) was developed for a series of s-triazine compounds by the multiple linear regression (MLR) analysis. An MLR procedure was used to model the relation-ships between molecular descriptors and retention of s-triazine derivatives. Physico-chemical molecular descriptors were calculated from the optimized structures. Statistically significant and physically meaningful QSRRs were obtained.
PB - Univerzitet u Novom Sadu
T2 - Acta Periodica Technologica
T1 - Estimation of the correlation between the retention of s-triazine derivatives and some molecular descriptors
EP - 239
SP - 231
VL - 42
DO - 10.2298/APT1142231J
ER -
@article{
author = "Jevrić, Lidija R. and Koprivica, Gordana B. and Mišljenović, Nevena M. and Tepić, Aleksandra N. and Kuljanin, Tatjana A. and Jovanović, Bratislav Ž.",
year = "2011",
abstract = "In this study, 14 newly synthesized s-triazine derivatives were investigated by means of reversed-phase thin-layer chromatography (TLC) on C-18 stationary and two different mobile phases: acetonitrile-water and methanol-water. Quantitative structure-retention relationship (QSRR) was developed for a series of s-triazine compounds by the multiple linear regression (MLR) analysis. An MLR procedure was used to model the relation-ships between molecular descriptors and retention of s-triazine derivatives. Physico-chemical molecular descriptors were calculated from the optimized structures. Statistically significant and physically meaningful QSRRs were obtained.",
publisher = "Univerzitet u Novom Sadu",
journal = "Acta Periodica Technologica",
title = "Estimation of the correlation between the retention of s-triazine derivatives and some molecular descriptors",
pages = "239-231",
volume = "42",
doi = "10.2298/APT1142231J"
}
Jevrić, L. R., Koprivica, G. B., Mišljenović, N. M., Tepić, A. N., Kuljanin, T. A.,& Jovanović, B. Ž.. (2011). Estimation of the correlation between the retention of s-triazine derivatives and some molecular descriptors. in Acta Periodica Technologica
Univerzitet u Novom Sadu., 42, 231-239.
https://doi.org/10.2298/APT1142231J
Jevrić LR, Koprivica GB, Mišljenović NM, Tepić AN, Kuljanin TA, Jovanović BŽ. Estimation of the correlation between the retention of s-triazine derivatives and some molecular descriptors. in Acta Periodica Technologica. 2011;42:231-239.
doi:10.2298/APT1142231J .
Jevrić, Lidija R., Koprivica, Gordana B., Mišljenović, Nevena M., Tepić, Aleksandra N., Kuljanin, Tatjana A., Jovanović, Bratislav Ž., "Estimation of the correlation between the retention of s-triazine derivatives and some molecular descriptors" in Acta Periodica Technologica, 42 (2011):231-239,
https://doi.org/10.2298/APT1142231J . .
