2-(1,3-dimethyl-1H-pyrazole-5-carbonyl)-8-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Chemical Structure Depiction of
2-(1,3-dimethyl-1H-pyrazole-5-carbonyl)-8-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
2-(1,3-dimethyl-1H-pyrazole-5-carbonyl)-8-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Compound characteristics
| Compound ID: | SC88-0626 |
| Compound Name: | 2-(1,3-dimethyl-1H-pyrazole-5-carbonyl)-8-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione |
| Molecular Weight: | 445.47 |
| Molecular Formula: | C20 H20 F N5 O4 S |
| Smiles: | Cc1cc(C(N2CC3(C2)C(CCS3(=O)=O)c2nc(c3ccc(cc3)F)no2)=O)n(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7728 |
| logD: | 1.7728 |
| logSw: | -2.5493 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 90.625 |
| InChI Key: | ZJMWOMSGBDCXEC-HNNXBMFYSA-N |