2-(2-ethylbutanoyl)-8-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Chemical Structure Depiction of
2-(2-ethylbutanoyl)-8-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
2-(2-ethylbutanoyl)-8-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Compound characteristics
| Compound ID: | SC88-1646 |
| Compound Name: | 2-(2-ethylbutanoyl)-8-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione |
| Molecular Weight: | 417.53 |
| Molecular Formula: | C21 H27 N3 O4 S |
| Smiles: | CCC(CC)C(N1CC2(C1)C(CCS2(=O)=O)c1nc(c2cccc(C)c2)no1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9891 |
| logD: | 3.9891 |
| logSw: | -4.062 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 77.574 |
| InChI Key: | TWKZTVSKSAQWBM-KRWDZBQOSA-N |