7-(4-benzylpiperazin-1-yl)-3-(3,5-dimethylbenzene-1-sulfonyl)-6-fluoro-1-methylquinolin-4(1H)-one
Chemical Structure Depiction of
7-(4-benzylpiperazin-1-yl)-3-(3,5-dimethylbenzene-1-sulfonyl)-6-fluoro-1-methylquinolin-4(1H)-one
7-(4-benzylpiperazin-1-yl)-3-(3,5-dimethylbenzene-1-sulfonyl)-6-fluoro-1-methylquinolin-4(1H)-one
Compound characteristics
| Compound ID: | E599-0613 |
| Compound Name: | 7-(4-benzylpiperazin-1-yl)-3-(3,5-dimethylbenzene-1-sulfonyl)-6-fluoro-1-methylquinolin-4(1H)-one |
| Molecular Weight: | 519.64 |
| Molecular Formula: | C29 H30 F N3 O3 S |
| Smiles: | Cc1cc(C)cc(c1)S(C1=CN(C)c2cc(c(cc2C1=O)F)N1CCN(CC1)Cc1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0737 |
| logD: | 4.0279 |
| logSw: | -4.2235 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.742 |
| InChI Key: | HSROZIUWSIPLGC-UHFFFAOYSA-N |