2-(3-fluoro-4-methylbenzoyl)-8-[(piperidin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Chemical Structure Depiction of
2-(3-fluoro-4-methylbenzoyl)-8-[(piperidin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
2-(3-fluoro-4-methylbenzoyl)-8-[(piperidin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Compound characteristics
| Compound ID: | SC89-0250 |
| Compound Name: | 2-(3-fluoro-4-methylbenzoyl)-8-[(piperidin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione |
| Molecular Weight: | 394.51 |
| Molecular Formula: | C20 H27 F N2 O3 S |
| Smiles: | Cc1ccc(cc1F)C(N1CC2(C1)C(CCS2(=O)=O)CN1CCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2322 |
| logD: | 0.9799 |
| logSw: | -2.6631 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.63 |
| InChI Key: | MSVPAOVKJUZBOC-KRWDZBQOSA-N |