2-(4-{4-nitro-3-[(quinolin-8-yl)sulfanyl]phenyl}piperazin-1-yl)ethan-1-ol
Chemical Structure Depiction of
2-(4-{4-nitro-3-[(quinolin-8-yl)sulfanyl]phenyl}piperazin-1-yl)ethan-1-ol
2-(4-{4-nitro-3-[(quinolin-8-yl)sulfanyl]phenyl}piperazin-1-yl)ethan-1-ol
Compound characteristics
| Compound ID: | 8008-6416 |
| Compound Name: | 2-(4-{4-nitro-3-[(quinolin-8-yl)sulfanyl]phenyl}piperazin-1-yl)ethan-1-ol |
| Molecular Weight: | 410.49 |
| Molecular Formula: | C21 H22 N4 O3 S |
| Smiles: | C1CN(CCN1CCO)c1ccc(c(c1)Sc1cccc2cccnc12)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.0955 |
| logD: | 2.9346 |
| logSw: | -3.279 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.479 |
| InChI Key: | YOWOUTNQFPMVJK-UHFFFAOYSA-N |