Kawakami K, Namba K, Tanaka M, Matsuhashi N, Sato K, Takemura M
New Product Research Laboratories I, Daiichi Pharmaceutical Co., Ltd. , Edogawa-ku, Tokyo 134-8630, Japan.
Antimicrob Agents Chemother. 2000 Aug;44(8):2126-9. doi: 10.1128/AAC.44.8.2126-2129.2000.
In order to investigate structure-activity relationships between antimycobacterial activities and basic substituents at the C-10 position of levofloxacin (LVFX), we synthesized a series of pyridobenzoxazine derivatives by replacement of the N-methylpiperazinyl group of LVFX with various basic substituents. A compound with a 3-aminopyrrolidinyl group had one-half the activity of LVFX against Mycobacterium avium, M. intracellulare, and M. tuberculosis. Mono- and dimethylation of the 3-amino moiety of the pyrrolidinyl group increased the activities against M. avium and M. intracellulare but not those against M. tuberculosis. On the other hand, dialkylation at the C-4 position of the 3-aminopyrrolidinyl group enhanced the activities against M. avium, M. intracellulare, and M. tuberculosis. Thus, introduction of an N-alkyl or a C-alkyl group(s) into the 3-aminopyrrolidinyl group may contribute to an increase in potency against M. avium, M. intracellulare, and/or M. tuberculosis, probably through elevation of the lipophilicity. However, among the compounds synthesized, compound VII, which was a 2,8-diazabicyclo[4.3.0]nonanyl derivative with relatively low lipophilicity, showed the most potent activity against mycobacterial species: the activity was 4- to 32-fold more potent than that of LVFX and two to four times as potent as that of gatifloxacin. These results suggested that an increase in the lipophilicity of LVFX analogues in part contributed to enhancement of antimycobacterial activities but that lipophilicity of the compound was not a critical factor affecting the potency.
为了研究左氧氟沙星(LVFX)C-10位抗分枝杆菌活性与碱性取代基之间的构效关系,我们通过用各种碱性取代基取代LVFX的N-甲基哌嗪基合成了一系列吡啶并苯并恶嗪衍生物。具有3-氨基吡咯烷基的化合物对鸟分枝杆菌、胞内分枝杆菌和结核分枝杆菌的活性是LVFX的一半。吡咯烷基3-氨基部分的单甲基化和二甲基化增加了对鸟分枝杆菌和胞内分枝杆菌的活性,但对结核分枝杆菌的活性没有增加。另一方面,3-氨基吡咯烷基C-4位的二烷基化增强了对鸟分枝杆菌、胞内分枝杆菌和结核分枝杆菌的活性。因此,在3-氨基吡咯烷基中引入N-烷基或C-烷基可能有助于提高对鸟分枝杆菌、胞内分枝杆菌和/或结核分枝杆菌的效力,可能是通过提高亲脂性。然而,在合成的化合物中,化合物VII,一种具有相对低亲脂性的2,8-二氮杂双环[4.3.0]壬烷基衍生物,对分枝杆菌属显示出最有效的活性:其活性比LVFX强4至32倍,比加替沙星强2至4倍。这些结果表明,LVFX类似物亲脂性的增加部分有助于增强抗分枝杆菌活性,但化合物的亲脂性不是影响效力的关键因素。