2-benzoyl-8-[(4-methylpiperazin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Chemical Structure Depiction of
2-benzoyl-8-[(4-methylpiperazin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
2-benzoyl-8-[(4-methylpiperazin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Compound characteristics
| Compound ID: | SC89-0400 |
| Compound Name: | 2-benzoyl-8-[(4-methylpiperazin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione |
| Molecular Weight: | 377.5 |
| Molecular Formula: | C19 H27 N3 O3 S |
| Smiles: | CN1CCN(CC1)CC1CCS(C12CN(C2)C(c1ccccc1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.348 |
| logD: | -0.5065 |
| logSw: | -1.9867 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.106 |
| InChI Key: | PSHHCIUIAQQMJZ-KRWDZBQOSA-N |