AC1LQXKM
1-ethyl-6-fluoro-7-[4-[(2-fluorophenyl)carbamothioyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid
Also Known As: KSC-13-90|AO-022/43453314|A3634/0154196|1-ethyl-6-fluoro-7-{4-[(2-fluoroanilino)carbothioyl]-1-piperazinyl}-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid|1-ethyl-6-fluoro-7-[4-[(2-fluorophenyl)carbamothioyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid|1-ethyl-6-fluoro-7-(4-((2-fluorophenyl)carbamothioyl)piperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid|1-ETHYL-6-FLUORO-7-{4-[(2-FLUOROANILINO)CARBOTHIOYL]PIPERAZINO}-4-OXO-1,4-DIHYDRO-3-QUINOLINECARBOXYLIC ACID|1-ethyl-6-fluoro-7-{4-[(2-fluorophenyl)carbamothioyl]piperazin-1-yl}-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
| Molecular Formula | C23H22F2N4O3S |
|---|---|
| Molecular Weight | 472.13806 g/mol |
| LogP | 3.5168 |
| Topological Polar Surface Area | 77.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 472.13806 |
| Monoisotopic Mass | 472.13806 |
| Heavy Atoms | 33 |
| Complexity | 1302.8416 |
Chemical Identifiers
| CAS Number | 697239-66-0 |
|---|---|
| SMILES | CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=S)NC4=CC=CC=C4F)F)C(=O)O |
Product Overview
AC1LQXKM (CAS 697239-66-0), with molecular formula C23H22F2N4O3S and molecular weight 472.13806 g/mol. IUPAC: 1-ethyl-6-fluoro-7-[4-[(2-fluorophenyl)carbamothioyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid.