2-[3-(4-fluorophenyl)-1H-pyrazole-4-carbonyl]-8-[(piperidin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Chemical Structure Depiction of
2-[3-(4-fluorophenyl)-1H-pyrazole-4-carbonyl]-8-[(piperidin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
2-[3-(4-fluorophenyl)-1H-pyrazole-4-carbonyl]-8-[(piperidin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Compound characteristics
| Compound ID: | SC89-0267 |
| Compound Name: | 2-[3-(4-fluorophenyl)-1H-pyrazole-4-carbonyl]-8-[(piperidin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione |
| Molecular Weight: | 446.54 |
| Molecular Formula: | C22 H27 F N4 O3 S |
| Smiles: | C1CCN(CC1)CC1CCS(C12CN(C2)C(c1c[nH]nc1c1ccc(cc1)F)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9213 |
| logD: | 0.669 |
| logSw: | -2.8218 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.82 |
| InChI Key: | GQSNYUABGJWNSR-KRWDZBQOSA-N |