2-[(4-ethoxyphenyl)acetyl]-8-[(4-methylpiperazin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Chemical Structure Depiction of
2-[(4-ethoxyphenyl)acetyl]-8-[(4-methylpiperazin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
2-[(4-ethoxyphenyl)acetyl]-8-[(4-methylpiperazin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Compound characteristics
| Compound ID: | SC89-1061 |
| Compound Name: | 2-[(4-ethoxyphenyl)acetyl]-8-[(4-methylpiperazin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione |
| Molecular Weight: | 435.59 |
| Molecular Formula: | C22 H33 N3 O4 S |
| Smiles: | CCOc1ccc(CC(N2CC3(C2)C(CCS3(=O)=O)CN2CCN(C)CC2)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1327 |
| logD: | 0.2782 |
| logSw: | -2.265 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 59.702 |
| InChI Key: | VSSGYQQEZPPTPI-IBGZPJMESA-N |