8-{3-[(4-methoxyphenyl)methyl]-1,2,4-oxadiazol-5-yl}-2-(1H-pyrazole-3-carbonyl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Chemical Structure Depiction of
8-{3-[(4-methoxyphenyl)methyl]-1,2,4-oxadiazol-5-yl}-2-(1H-pyrazole-3-carbonyl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
8-{3-[(4-methoxyphenyl)methyl]-1,2,4-oxadiazol-5-yl}-2-(1H-pyrazole-3-carbonyl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Compound characteristics
| Compound ID: | SC88-1720 |
| Compound Name: | 8-{3-[(4-methoxyphenyl)methyl]-1,2,4-oxadiazol-5-yl}-2-(1H-pyrazole-3-carbonyl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione |
| Molecular Weight: | 443.48 |
| Molecular Formula: | C20 H21 N5 O5 S |
| Smiles: | COc1ccc(Cc2nc(C3CCS(C34CN(C4)C(c3cc[nH]n3)=O)(=O)=O)on2)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3414 |
| logD: | 1.3414 |
| logSw: | -2.3641 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 109.438 |
| InChI Key: | IGGIQTFUAWLIFC-HNNXBMFYSA-N |