6-[(2,5-difluorobenzene-1-sulfonyl)amino]-2-[4-(4-methylpentan-2-yl)piperazin-1-yl]quinoline-4-carboxylic acid
Chemical Structure Depiction of
6-[(2,5-difluorobenzene-1-sulfonyl)amino]-2-[4-(4-methylpentan-2-yl)piperazin-1-yl]quinoline-4-carboxylic acid
6-[(2,5-difluorobenzene-1-sulfonyl)amino]-2-[4-(4-methylpentan-2-yl)piperazin-1-yl]quinoline-4-carboxylic acid
Compound characteristics
Compound ID: | F447-0578 |
Compound Name: | 6-[(2,5-difluorobenzene-1-sulfonyl)amino]-2-[4-(4-methylpentan-2-yl)piperazin-1-yl]quinoline-4-carboxylic acid |
Molecular Weight: | 641.99 |
Molecular Formula: | C26 H30 F2 N4 O4 S |
Salt: | 3HCl |
Smiles: | CC(C)CC(C)N1CCN(CC1)c1cc(C(O)=O)c2cc(ccc2n1)NS(c1cc(ccc1F)F)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.7215 |
logD: | 5.7215 |
logSw: | -5.4752 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 83.991 |
InChI Key: | IEAISOOVVZZUDR-KRWDZBQOSA-N |