1-butyl-6-fluoro-3-(3-methylbenzene-1-sulfonyl)-7-(4-methylpiperazin-1-yl)quinolin-4(1H)-one
Chemical Structure Depiction of
1-butyl-6-fluoro-3-(3-methylbenzene-1-sulfonyl)-7-(4-methylpiperazin-1-yl)quinolin-4(1H)-one
1-butyl-6-fluoro-3-(3-methylbenzene-1-sulfonyl)-7-(4-methylpiperazin-1-yl)quinolin-4(1H)-one
Compound characteristics
| Compound ID: | E599-0571 |
| Compound Name: | 1-butyl-6-fluoro-3-(3-methylbenzene-1-sulfonyl)-7-(4-methylpiperazin-1-yl)quinolin-4(1H)-one |
| Molecular Weight: | 471.59 |
| Molecular Formula: | C25 H30 F N3 O3 S |
| Smiles: | CCCCN1C=C(C(c2cc(c(cc12)N1CCN(C)CC1)F)=O)S(c1cccc(C)c1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7278 |
| logD: | 3.4094 |
| logSw: | -3.8828 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.941 |
| InChI Key: | WYWYAHGVLFXABH-UHFFFAOYSA-N |