8-({5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl}sulfanyl)quinoline
Chemical Structure Depiction of
8-({5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl}sulfanyl)quinoline
8-({5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl}sulfanyl)quinoline
Compound characteristics
| Compound ID: | 3371-1075 |
| Compound Name: | 8-({5-[4-(benzenesulfonyl)piperazin-1-yl]-2-nitrophenyl}sulfanyl)quinoline |
| Molecular Weight: | 506.6 |
| Molecular Formula: | C25 H22 N4 O4 S2 |
| Smiles: | C1CN(CCN1c1ccc(c(c1)Sc1cccc2cccnc12)[N+]([O-])=O)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6134 |
| logD: | 4.611 |
| logSw: | -4.5947 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 77.552 |
| InChI Key: | UADSZLDJOHWLHZ-UHFFFAOYSA-N |