6-[(4-fluorobenzene-1-sulfonyl)amino]-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinoline-4-carboxylic acid
Chemical Structure Depiction of
6-[(4-fluorobenzene-1-sulfonyl)amino]-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinoline-4-carboxylic acid
6-[(4-fluorobenzene-1-sulfonyl)amino]-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinoline-4-carboxylic acid
Compound characteristics
Compound ID: | F447-0017 |
Compound Name: | 6-[(4-fluorobenzene-1-sulfonyl)amino]-2-[4-(pyrimidin-2-yl)piperazin-1-yl]quinoline-4-carboxylic acid |
Molecular Weight: | 617.91 |
Molecular Formula: | C24 H21 F N6 O4 S |
Salt: | 3HCl |
Smiles: | C1CN(CCN1c1cc(C(O)=O)c2cc(ccc2n1)NS(c1ccc(cc1)F)(=O)=O)c1ncccn1 |
Stereo: | ACHIRAL |
logP: | 4.6901 |
logD: | 1.746 |
logSw: | -4.4352 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 102.165 |
InChI Key: | ROFGTDNMBHJMSZ-UHFFFAOYSA-N |