3-Quinolinecarboxylicacid,1-cyclopropyl-6-fluoro-1,4-dihydro-8-methoxy-7-[3-[(methylamino)methyl]-1-pyrrolidinyl]-4-oxo- | 112811-75-3
3-Quinolinecarboxylicacid,1-cyclopropyl-6-fluoro-1,4-dihydro-8-methoxy-7-[3-[(methylamino)methyl]-1-pyrrolidinyl]-4-oxo-
112811-75-3
C20H24N3O4F
389.42066
名称和标识符
InChIKey |
ITLUJXOWXJGURR-UHFFFAOYSA-N |
Inchi |
InChI=1S/C20H24FN3O4/c1-22-8-11-5-6-23(9-11)17-15(21)7-13-16(19(17)28-2)24(12-3-4-12)10-14(18(13)25)20(26)27/h7,10-12,22H,3-6,8-9H2,1-2H3,(H,26,27) |
SMILES |
C1(N2C3C(=CC(F)=C(N4CCC(CNC)C4)C=3OC)C(=O)C(C(O)=O)=C2)CC1 |
别名信息
- 英文别名 -
- 3-Quinolinecarboxylicacid,1-cyclopropyl-6-fluoro-1,4-dihydro-8-methoxy-7-[3-[(methylamino)methyl]-1-pyrrolidinyl]-4-oxo-
- 1-cyclopropyl-6-fluoro-8-methoxy-7-[3-(methylaminomethyl)pyrrolidin-1-yl]-4-oxoquinoline-3-carboxylic acid
- 3-Quinolinecarboxylic acid, 1-cyclopropyl-6-fluoro-1,4-dihydro-8-Methoxy-7-[3-[(MethylaMino)Methyl]-1-pyrrolidinyl]-4-oxo-
- 1-Cyclopropyl-6-fluoro-8-methoxy-7-(3-((methylamino)methyl)pyrrolidin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
- 112811-75-3
- 112811-75-3
- 3-Quinolinecarboxylic acid, 1-cyclopropyl-6-fluoro-1,4-dihydro-8-methoxy-7-(3-((methylamino)methyl)-1-pyrrolidinyl)-4-oxo-
- 3-Quinolinecarboxylic acid, 1-cyclopropyl-6-fluoro-1,4-dihydro-8-methoxy-7-(3-((methylamino)methyl)-1-pyrrolidinyl)-4-oxo-
- ITLUJXOWXJGURR-UHFFFAOYSA-N
- ITLUJXOWXJGURR-UHFFFAOYSA-N
- 1-cyclopropyl-6-fluoro-8-methoxy-7-{3-[(methylamino)methyl]pyrrolidin-1-yl}-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
- 1-cyclopropyl-6-fluoro-8-methoxy-7-{3-[(methylamino)methyl]pyrrolidin-1-yl}-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
- SCHEMBL9373032
- SCHEMBL9373032
- 1-cyclopropyl-6-fluoro-8-methoxy-7-[3-(methylaminomethyl)pyrrolidin-1-yl]-4-oxo-quinoline-3-carboxylic acid
- 1-cyclopropyl-6-fluoro-8-methoxy-7-[3-(methylaminomethyl)pyrrolidin-1-yl]-4-oxo-quinoline-3-carboxylic acid
- DTXSID30920909
- DTXSID30920909
- 1-cyclopropyl-6-fluoro-1,4-dihydro-8-methoxy-7-(3-methylaminomethyl-1-pyrrolidinyl)-4-oxo-3-quinolinecarboxylic acid
- 1-cyclopropyl-6-fluoro-1,4-dihydro-8-methoxy-7-(3-methylaminomethyl-1-pyrrolidinyl)-4-oxo-3-quinolinecarboxylic acid
- 3-Quinolinecarboxylic acid, 1-cyclopropyl-6-fluoro-1,4-dihydro-8-methoxy-7-[3-[(methylamino)methyl]-1-pyrrolidinyl]-4-oxo-
- 3-Quinolinecarboxylic acid, 1-cyclopropyl-6-fluoro-1,4-dihydro-8-methoxy-7-[3-[(methylamino)methyl]-1-pyrrolidinyl]-4-oxo-
物化性质
实验特性
计算特性
精确分子量 |
389.17522 |
氢键供体数量 |
2 |
氢键受体数量 |
8 |
可旋转化学键数量 |
6 |
同位素质量 |
389.17508442g/mol |
重原子数量 |
28 |
复杂度 |
668 |
同位素原子数量 |
0 |
确定原子立构中心数量 |
0 |
不确定原子立构中心数量 |
1 |
确定化学键立构中心数量 |
0 |
不确定化学键立构中心数量 |
0 |
共价键单元数量 |
1 |
疏水参数计算参考值(XlogP) |
0.4 |
拓扑分子极性表面积 |
82.1Ų |
3-Quinolinecarboxylicacid,1-cyclopropyl-6-fluoro-1,4-dihydro-8-methoxy-7-[3-[(methylamino)methyl]-1-pyrrolidinyl]-4-oxo-推荐生产厂家