2-acetyl-8-{3-[(4-methoxyphenyl)methyl]-1,2,4-oxadiazol-5-yl}-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Chemical Structure Depiction of
2-acetyl-8-{3-[(4-methoxyphenyl)methyl]-1,2,4-oxadiazol-5-yl}-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
2-acetyl-8-{3-[(4-methoxyphenyl)methyl]-1,2,4-oxadiazol-5-yl}-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Compound characteristics
| Compound ID: | SC88-1728 |
| Compound Name: | 2-acetyl-8-{3-[(4-methoxyphenyl)methyl]-1,2,4-oxadiazol-5-yl}-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione |
| Molecular Weight: | 391.44 |
| Molecular Formula: | C18 H21 N3 O5 S |
| Smiles: | CC(N1CC2(C1)C(CCS2(=O)=O)c1nc(Cc2ccc(cc2)OC)no1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2965 |
| logD: | 1.2965 |
| logSw: | -2.2271 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 86.576 |
| InChI Key: | UMDRDTKXOWTXFG-HNNXBMFYSA-N |