2-(4-phenylbutanoyl)-8-[(pyrrolidin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Chemical Structure Depiction of
2-(4-phenylbutanoyl)-8-[(pyrrolidin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
2-(4-phenylbutanoyl)-8-[(pyrrolidin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Compound characteristics
| Compound ID: | SC89-0149 |
| Compound Name: | 2-(4-phenylbutanoyl)-8-[(pyrrolidin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione |
| Molecular Weight: | 390.54 |
| Molecular Formula: | C21 H30 N2 O3 S |
| Smiles: | C(CC(N1CC2(C1)C(CCS2(=O)=O)CN1CCCC1)=O)Cc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3813 |
| logD: | 0.7078 |
| logSw: | -2.4865 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.468 |
| InChI Key: | MAYPWLGSGPAGKO-IBGZPJMESA-N |