中文名 | 芦氟沙星 |
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英文名 | Rufloxacin |
中文别名 |
如氟沙星
9-氟-2,3-二氢-10-(4-甲基-1-哌嗪基)-7-氧代-7H-吡啶并[1,2,3-DE]-1,4-苯并噻嗪-6-羧酸 |
英文别名 |
MF 934
7H-Pyrido[1,2,3-de]-1,4-benzothiazine-6-carboxylicacid,9-fluoro-2,3-dihydro-10-(4-methyl-1-piperazinyl)-7-oxo 9-fluoro-10-(4-methylpiperazin-1-yl)-7-oxo-2,3-dihydro-7h-[1,4]thiazino[2,3,4-ij]quinoline-6-carboxylic acid 9-fluoro-2,3-dihydro-10-(4-methyl-1-pyrazinyl)-7-oxo-7-H-pyrido[1,2,3-de]-1,4-benzothiazin-6-carboxylic acid RUFLOXACIN HCl 9-fluoro-2,3-dihydro-10-(4-methylpiperazin-1-yl)-7-oxo-7H-pyrido[1,2,3-de][1,4]benzothiazin-6-carboxylic acid 9-fluoro-10-(4-methyl-1-piperazinyl)-7-oxo-2,3-dihydro-7H-pyrido<1,2,3-de><1,4>benzothiazine-6-carboxylic acid |
密度 | 1.54 g/cm3 |
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沸点 | 574.6ºC at 760 mmHg |
分子式 | C17H18FN3O3S |
分子量 | 363.40700 |
闪点 | 301.3ºC |
精确质量 | 363.10500 |
PSA | 91.08000 |
LogP | 1.69920 |
蒸汽压 | 4.81E-14mmHg at 25°C |
稳定性 | 盐酸芦氟沙星(Rufloxacin Hydrochloride):C17H18FN3O3S?HCl。[106017-08-7]。在乙醇-水中结晶,熔点322~324℃。急性毒性LD50兔子,雄大鼠,雌大鼠(mg/kg):660,631,501口服。 |
分子结构 | 1、 摩尔折射率:77.70 2、 摩尔体积(cm3/mol):202.8 3、 等张比容(90.2K):599.7 4、 表面张力(dyne/cm):76.4 5、 极化率(10-24cm3):30.80 |
计算化学 | 1.疏水参数计算参考值(XlogP):无 2.氢键供体数量:1 3.氢键受体数量:8 4.可旋转化学键数量:2 5.互变异构体数量:无 6.拓扑分子极性表面积89.4 7.重原子数量:25 8.表面电荷:0 9.复杂度:608 10.同位素原子数量:0 11.确定原子立构中心数量:0 12.不确定原子立构中心数量:0 13.确定化学键立构中心数量:0 14.不确定化学键立构中心数量:0 15.共价键单元数量:1 |
~59% 101363-10-4 |
文献:Cecchetti, Violetta; Fravolini, Arnaldo; Fringuelli, Renata; Mascellani, Giuseppe; Pagella, Piergiuseppe; et al. Journal of Medicinal Chemistry, 1987 , vol. 30, # 3 p. 465 - 473 |
~% 101363-10-4 |
文献:Journal of Medicinal Chemistry, , vol. 30, # 3 p. 465 - 473 |
~% 101363-10-4 |
文献:Journal of Medicinal Chemistry, , vol. 30, # 3 p. 465 - 473 |
~% 101363-10-4 |
文献:Journal of Medicinal Chemistry, , vol. 30, # 3 p. 465 - 473 |
~% 101363-10-4 |
文献:Journal of Medicinal Chemistry, , vol. 30, # 3 p. 465 - 473 |
~% 101363-10-4 |
文献:Journal of Medicinal Chemistry, , vol. 30, # 3 p. 465 - 473 |
~% 101363-10-4 |
文献:Journal of Medicinal Chemistry, , vol. 30, # 3 p. 465 - 473 |
~% 101363-10-4 |
文献:Journal of Medicinal Chemistry, , vol. 30, # 3 p. 465 - 473 |
上游产品 4 | |
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下游产品 1 | |