7-(4-benzylpiperazin-1-yl)-3-(3-chlorobenzene-1-sulfonyl)-6-fluoro-1-methylquinolin-4(1H)-one
Chemical Structure Depiction of
7-(4-benzylpiperazin-1-yl)-3-(3-chlorobenzene-1-sulfonyl)-6-fluoro-1-methylquinolin-4(1H)-one
7-(4-benzylpiperazin-1-yl)-3-(3-chlorobenzene-1-sulfonyl)-6-fluoro-1-methylquinolin-4(1H)-one
Compound characteristics
| Compound ID: | E599-0691 |
| Compound Name: | 7-(4-benzylpiperazin-1-yl)-3-(3-chlorobenzene-1-sulfonyl)-6-fluoro-1-methylquinolin-4(1H)-one |
| Molecular Weight: | 526.03 |
| Molecular Formula: | C27 H25 Cl F N3 O3 S |
| Smiles: | CN1C=C(C(c2cc(c(cc12)N1CCN(CC1)Cc1ccccc1)F)=O)S(c1cccc(c1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8606 |
| logD: | 3.8147 |
| logSw: | -4.2162 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.742 |
| InChI Key: | CURKGGUTILRQCH-UHFFFAOYSA-N |