SITAFLOXACIN-西他沙星-IMPURITY 基本信息
| 中文名称 | SITAFLOXACIN-西他沙星-IMPURITY |
|---|---|
| 中文同义词 | SITAFLOXACIN-西他沙星-IMPURITY;西他沙星杂质07;西他沙星杂质16;西他沙星04;西他沙星48;西他沙星杂质D5 |
| 英文名称 | (S)-7-(7-amino-5-azaspiro[2.4]heptan-5-yl)-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid |
| 英文同义词 | (S)-7-(7-amino-5-azaspiro[2.4]heptan-5-yl)-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid;4-((S)-7-amino-5-azaspiro[2.4]heptan-5-yl)-3-chloro-5-fluoro-2-((1R,2S)-2-fluorocyclopropyl)-1a,2-dihydrooxireno[2,3-b]quinolin-7(7aH)-one;(S)-7-(7-amino-5-azaspiro[2.4]heptan-5-yl)-8-chloro-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid;7-((S)-7-amino-5-azaspiro[2.4]heptan-5-yl)-8-chloro-1-((1R,2S)-2-fluorocyclopropyl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid;(1R,2R)-2-fluorocyclopropanamine;(1S,2S)-2-fluorocyclopropanamine;Sitafloxacin Impurity 16;7-((S)-7-amino-5-azaspiro[2.4]heptan-5-yl)-8-chloro-6-fluoro-1-((1R,2S)-2-fluorocyclopropyl)-4-imino-1,4-dihydroquinoline-3-carboxylic acid |
| CAS号 | 148693-51-0 |
| 分子式 | C16H15ClFN3O3 |
| 分子量 | 351.76 |
| EINECS号 | |
| 相关类别 | 242-西他沙星 |
| Mol文件 | 148693-51-0.mol |
| 结构式 |  |
SITAFLOXACIN-西他沙星-IMPURITY 性质
| 沸点 | 564.7±50.0 °C(Predicted) |
|---|---|
| 密度 | 1.63±0.1 g/cm3(Predicted) |
| 酸度系数(pKa) | 6.42±0.50(Predicted) |
| InChI | InChI=1S/C16H15ClFN3O3/c17-11-12-7(14(22)8(4-20-12)15(23)24)3-9(18)13(11)21-5-10(19)16(6-21)1-2-16/h3-4,10H,1-2,5-6,19H2,(H,20,22)(H,23,24)/t10-/m1/s1 |
| InChIKey | LFMNPYBCUCEZID-SNVBAGLBSA-N |
| SMILES | N1C2=C(C=C(F)C(N3C[C@@H](N)C4(CC4)C3)=C2Cl)C(=O)C(C(O)=O)=C1 |