108461-04-7
中文名称
N-DESMETHYLDANOFLOXACIN
英文名称
N-DESMETHYLDANOFLOXACIN
CAS
108461-04-7
分子式
C18H18FN3O3
分子量
343.35
MOL 文件
108461-04-7.mol
108461-04-7 结构式
基本信息
英文别名
DESMETHYLDANOFLOXACINN-DESMETHYLDANOFLOXACIN
CP-74416 methanesulfonate hydrate
CP-074416 methanesulfonate hydrate
N-desmethyldanofloxacin methanesulfonate hydrate
Danofloxacin Impurity 1（N-Desmethyl Danofloxacin）
1-Cyclopropyl-7-(1S,4S)-2,5-diazabicyclo[2.2.1]hept-2-yl-6-fluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic Acid
3-Quinolinecarboxylic acid, 1-cyclopropyl-7-(1S,4S)-2,5-diazabicyclo[2.2.1]hept-2-yl-6-fluoro-1,4-dihydro-4-oxo-
1-Cyclopropyl-6-fluoro-1,4-dihydro-7-[(1β,4β)-3,6-diazabicyclo[2.2.1]heptan-3-yl]-4-oxoquinoline-3-carboxylic acid
1-Cyclopropyl-6-fluoro-7-[(1α,4α)-2,5-diazabicyclo[2.2.1]heptane-2-yl]-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
物理化学性质
熔点>220°C (dec.)
储存条件room temp
溶解度H2O：≥22mg/mL
形态粉末
颜色白色至棕褐色
水溶解性H2O: ≥22mg/mL
InChI1S/C18H18FN3O3/c19-14-4-12-15(5-16(14)21-7-9-3-11(21)6-20-9)22(10-1-2-10)8-13(17(12)23)18(24)25/h4-5,8-11,20H,1-3,6-7H2,(H,24,25)/t9-,11-/m0/s1
InChIKeyLHZDPJRHQVYKPA-ONGXEEELSA-N
SMILESFc1cc2c(cc1N4[C@@H]5C[N+H2][C@H](C4)C5)N(C=C(C2=O)C(=O)[O-])C3CC3