8-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-(thiophene-2-carbonyl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Chemical Structure Depiction of
8-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-(thiophene-2-carbonyl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
8-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-(thiophene-2-carbonyl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Compound characteristics
| Compound ID: | SC88-1594 |
| Compound Name: | 8-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-(thiophene-2-carbonyl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione |
| Molecular Weight: | 449.93 |
| Molecular Formula: | C19 H16 Cl N3 O4 S2 |
| Smiles: | C1CS(C2(CN(C2)C(c2cccs2)=O)C1c1nc(c2ccc(cc2)[Cl])no1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8179 |
| logD: | 3.8179 |
| logSw: | -4.5341 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 78.321 |
| InChI Key: | YTPNINDPPOEZMA-CQSZACIVSA-N |