2-(5-methylthiophene-2-carbonyl)-8-(3-phenyl-1,2,4-oxadiazol-5-yl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Chemical Structure Depiction of
2-(5-methylthiophene-2-carbonyl)-8-(3-phenyl-1,2,4-oxadiazol-5-yl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
2-(5-methylthiophene-2-carbonyl)-8-(3-phenyl-1,2,4-oxadiazol-5-yl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Compound characteristics
Compound ID: | SC88-0555 |
Compound Name: | 2-(5-methylthiophene-2-carbonyl)-8-(3-phenyl-1,2,4-oxadiazol-5-yl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione |
Molecular Weight: | 429.52 |
Molecular Formula: | C20 H19 N3 O4 S2 |
Smiles: | Cc1ccc(C(N2CC3(C2)C(CCS3(=O)=O)c2nc(c3ccccc3)no2)=O)s1 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.754 |
logD: | 3.754 |
logSw: | -3.8997 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 78.321 |
InChI Key: | BMWTXEFMNKVMBB-HNNXBMFYSA-N |