3-(3,5-dimethylbenzene-1-sulfonyl)-1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)quinolin-4(1H)-one
Chemical Structure Depiction of
3-(3,5-dimethylbenzene-1-sulfonyl)-1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)quinolin-4(1H)-one
3-(3,5-dimethylbenzene-1-sulfonyl)-1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)quinolin-4(1H)-one
Compound characteristics
| Compound ID: | E599-0624 |
| Compound Name: | 3-(3,5-dimethylbenzene-1-sulfonyl)-1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)quinolin-4(1H)-one |
| Molecular Weight: | 457.57 |
| Molecular Formula: | C24 H28 F N3 O3 S |
| Smiles: | CCN1C=C(C(c2cc(c(cc12)N1CCN(C)CC1)F)=O)S(c1cc(C)cc(C)c1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2021 |
| logD: | 2.8838 |
| logSw: | -3.7529 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.688 |
| InChI Key: | UVWUWAHRKWLJQM-UHFFFAOYSA-N |