3-(4-benzylpiperazin-1-yl)-6-bromo-4H-1-benzothiopyran-4-one
Chemical Structure Depiction of
3-(4-benzylpiperazin-1-yl)-6-bromo-4H-1-benzothiopyran-4-one
3-(4-benzylpiperazin-1-yl)-6-bromo-4H-1-benzothiopyran-4-one
Compound characteristics
| Compound ID: | G617-0294 |
| Compound Name: | 3-(4-benzylpiperazin-1-yl)-6-bromo-4H-1-benzothiopyran-4-one |
| Molecular Weight: | 415.35 |
| Molecular Formula: | C20 H19 Br N2 O S |
| Smiles: | C1CN(CCN1Cc1ccccc1)C1=CSc2ccc(cc2C1=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.6552 |
| logD: | 4.653 |
| logSw: | -4.5691 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 20.0253 |
| InChI Key: | AURMELBAODYABE-UHFFFAOYSA-N |