2-[(4-methylphenyl)acetyl]-8-[(pyrrolidin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Chemical Structure Depiction of
2-[(4-methylphenyl)acetyl]-8-[(pyrrolidin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
2-[(4-methylphenyl)acetyl]-8-[(pyrrolidin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Compound characteristics
| Compound ID: | SC89-0186 |
| Compound Name: | 2-[(4-methylphenyl)acetyl]-8-[(pyrrolidin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione |
| Molecular Weight: | 376.52 |
| Molecular Formula: | C20 H28 N2 O3 S |
| Smiles: | Cc1ccc(CC(N2CC3(C2)C(CCS3(=O)=O)CN2CCCC2)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9149 |
| logD: | 0.2414 |
| logSw: | -2.3532 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.468 |
| InChI Key: | XCBPSNKMTALQHJ-SFHVURJKSA-N |