3-(benzenesulfonyl)-7-(4-benzylpiperazin-1-yl)-6-fluoro-1-methylquinolin-4(1H)-one
Chemical Structure Depiction of
3-(benzenesulfonyl)-7-(4-benzylpiperazin-1-yl)-6-fluoro-1-methylquinolin-4(1H)-one
3-(benzenesulfonyl)-7-(4-benzylpiperazin-1-yl)-6-fluoro-1-methylquinolin-4(1H)-one
Compound characteristics
| Compound ID: | E599-0014 |
| Compound Name: | 3-(benzenesulfonyl)-7-(4-benzylpiperazin-1-yl)-6-fluoro-1-methylquinolin-4(1H)-one |
| Molecular Weight: | 491.58 |
| Molecular Formula: | C27 H26 F N3 O3 S |
| Smiles: | CN1C=C(C(c2cc(c(cc12)N1CCN(CC1)Cc1ccccc1)F)=O)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2169 |
| logD: | 3.1711 |
| logSw: | -3.7826 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.742 |
| InChI Key: | SDYYPYMCYUPWRU-UHFFFAOYSA-N |