Correlation of antibacterial activity of some N-[5-(2-furanyl)-2-methyl-4-oxo-4H-thieno[2,3-d]pyrimidin-3-yl]-carboxamide and 3-substituted-5-(2-furanyl)-2-methyl-3H-thieno[2,3-d]pyrimidin-4-ones with topological indices using Hansch analysis.
The antimicrobial activity of the N-[5-(2-furanyl)-2-methyl-4-oxo-4H-theino[2,3-d]pyrimidin-3-y1]-carboxamides and 3-substituted-5-(2-furanyl)-2-methyl-3H-thieno[2,3-d]pyrimidin-4-ones was correlated with different topological indices using Hansch analysis. Good correlations were obtained through a simple regression equation with third order molecular connectivity index (3chi). The developed QSAR models were crossvalidated by leave-one-out technique.
Narasimhan
Balasubramanian
B
Department of Pharmaceutical Sciences, Guru Jambheshwar University, Hisar 125001, India. naru2000us@yahoo.com
Kumari
Meena
M
Jain
Nitin
N
Dhake
Avinash
A
Sundaravelan
Chandrasekaran
C
D000818:Animals; D000900:Anti-Bacterial Agents / Q000737:chemistry* / Q000494:pharmacology*; D001412:Bacillus subtilis / Q000187:drug effects; D005663:Furans / Q000737:chemistry* / Q000494:pharmacology*; D006090:Gram-Negative Bacteria / Q000187:drug effects; D006094:Gram-Positive Bacteria / Q000187:drug effects; D008745:Methylation; D015394:Molecular Structure; D011743:Pyrimidines / Q000737:chemistry* / Q000494:pharmacology*; D021281:Quantitative Structure-Activity Relationship
D000900:Anti-Bacterial Agents; D005663:Furans; C514081:N-(5-(2-furanyl)-2-methyl-4-oxo-4H-thieno(2,3-d)pyrimidin-3-yl)-carboxamide; D011743:Pyrimidines; C030986:pyrimidine