1-ethyl-6-fluoro-4-oxo-7-{4-[(prop-2-en-1-yl)carbamothioyl]piperazin-1-yl}-1,4-dihydroquinoline-3-carboxylic acid
Chemical Structure Depiction of
1-ethyl-6-fluoro-4-oxo-7-{4-[(prop-2-en-1-yl)carbamothioyl]piperazin-1-yl}-1,4-dihydroquinoline-3-carboxylic acid
1-ethyl-6-fluoro-4-oxo-7-{4-[(prop-2-en-1-yl)carbamothioyl]piperazin-1-yl}-1,4-dihydroquinoline-3-carboxylic acid
Compound characteristics
| Compound ID: | 8015-4900 |
| Compound Name: | 1-ethyl-6-fluoro-4-oxo-7-{4-[(prop-2-en-1-yl)carbamothioyl]piperazin-1-yl}-1,4-dihydroquinoline-3-carboxylic acid |
| Molecular Weight: | 418.49 |
| Molecular Formula: | C20 H23 F N4 O3 S |
| Smiles: | CCN1C=C(C(O)=O)C(c2cc(c(cc12)N1CCN(CC1)C(NCC=C)=S)F)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0132 |
| logD: | -1.173 |
| logSw: | -2.2198 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.26 |
| InChI Key: | GZLXKFCQMMBADQ-UHFFFAOYSA-N |