6-[(3-fluorobenzene-1-sulfonyl)amino]-2-[4-(4-methoxyphenyl)piperazin-1-yl]quinoline-4-carboxylic acid--hydrogen chloride (1/3)
Chemical Structure Depiction of
6-[(3-fluorobenzene-1-sulfonyl)amino]-2-[4-(4-methoxyphenyl)piperazin-1-yl]quinoline-4-carboxylic acid--hydrogen chloride (1/3)
6-[(3-fluorobenzene-1-sulfonyl)amino]-2-[4-(4-methoxyphenyl)piperazin-1-yl]quinoline-4-carboxylic acid--hydrogen chloride (1/3)
Compound characteristics
| Compound ID: | F447-0479 |
| Compound Name: | 6-[(3-fluorobenzene-1-sulfonyl)amino]-2-[4-(4-methoxyphenyl)piperazin-1-yl]quinoline-4-carboxylic acid--hydrogen chloride (1/3) |
| Molecular Weight: | 645.96 |
| Molecular Formula: | C27 H25 F N4 O5 S |
| Salt: | 3HCl |
| Smiles: | COc1ccc(cc1)N1CCN(CC1)c1cc(C(O)=O)c2cc(ccc2n1)NS(c1cccc(c1)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5936 |
| logD: | 2.6495 |
| logSw: | -5.5257 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.347 |
| InChI Key: | KRPACWUXXVQKMI-UHFFFAOYSA-N |