6-[(2,5-difluorobenzene-1-sulfonyl)amino]-2-(4-ethylpiperazin-1-yl)quinoline-4-carboxylic acid--hydrogen chloride (1/3)
Chemical Structure Depiction of
6-[(2,5-difluorobenzene-1-sulfonyl)amino]-2-(4-ethylpiperazin-1-yl)quinoline-4-carboxylic acid--hydrogen chloride (1/3)
6-[(2,5-difluorobenzene-1-sulfonyl)amino]-2-(4-ethylpiperazin-1-yl)quinoline-4-carboxylic acid--hydrogen chloride (1/3)
Compound characteristics
| Compound ID: | F447-0568 |
| Compound Name: | 6-[(2,5-difluorobenzene-1-sulfonyl)amino]-2-(4-ethylpiperazin-1-yl)quinoline-4-carboxylic acid--hydrogen chloride (1/3) |
| Molecular Weight: | 585.88 |
| Molecular Formula: | C22 H22 F2 N4 O4 S |
| Salt: | 3HCl |
| Smiles: | CCN1CCN(CC1)c1cc(C(O)=O)c2cc(ccc2n1)NS(c1cc(ccc1F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1111 |
| logD: | 4.1111 |
| logSw: | -4.0468 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.08 |
| InChI Key: | QNLGVOLUCUCUEH-UHFFFAOYSA-N |