3-{4-[(1-oxophthalazin-2(1H)-yl)acetyl]piperazin-1-yl}-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
3-{4-[(1-oxophthalazin-2(1H)-yl)acetyl]piperazin-1-yl}-1lambda~6~-thiolane-1,1-dione
3-{4-[(1-oxophthalazin-2(1H)-yl)acetyl]piperazin-1-yl}-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | Y041-4371 |
| Compound Name: | 3-{4-[(1-oxophthalazin-2(1H)-yl)acetyl]piperazin-1-yl}-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 390.46 |
| Molecular Formula: | C18 H22 N4 O4 S |
| Smiles: | C1CS(CC1N1CCN(CC1)C(CN1C(c2ccccc2C=N1)=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -1.3082 |
| logD: | -1.3082 |
| logSw: | -2.3604 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 76.153 |
| InChI Key: | LRSWDODMLDVIAW-OAHLLOKOSA-N |