4-{[(butan-2-yl)(quinoline-8-sulfonyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
4-{[(butan-2-yl)(quinoline-8-sulfonyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
4-{[(butan-2-yl)(quinoline-8-sulfonyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V012-5253 |
| Compound Name: | 4-{[(butan-2-yl)(quinoline-8-sulfonyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 528.62 |
| Molecular Formula: | C26 H25 F N2 O5 S2 |
| Salt: | not_available |
| Smiles: | CCC(C)N(Cc1ccc(cc1)OS(c1ccc(cc1)F)(=O)=O)S(c1cccc2cccnc12)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0228 |
| logD: | 5.0228 |
| logSw: | -4.8854 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 77.275 |
| InChI Key: | LFZKDRKXHGJBEZ-IBGZPJMESA-N |