8-[(4-methylpiperazin-1-yl)methyl]-2-(3-phenylpropanoyl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Chemical Structure Depiction of
8-[(4-methylpiperazin-1-yl)methyl]-2-(3-phenylpropanoyl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
8-[(4-methylpiperazin-1-yl)methyl]-2-(3-phenylpropanoyl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Compound characteristics
| Compound ID: | SC89-0453 |
| Compound Name: | 8-[(4-methylpiperazin-1-yl)methyl]-2-(3-phenylpropanoyl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione |
| Molecular Weight: | 405.56 |
| Molecular Formula: | C21 H31 N3 O3 S |
| Smiles: | CN1CCN(CC1)CC1CCS(C12CN(C2)C(CCc1ccccc1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0725 |
| logD: | 0.218 |
| logSw: | -2.2089 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.579 |
| InChI Key: | NTZWBCYXYWHNLS-IBGZPJMESA-N |