8-{3-[(4-methoxyphenyl)methyl]-1,2,4-oxadiazol-5-yl}-2-[(1-methyl-1H-pyrazol-4-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Chemical Structure Depiction of
8-{3-[(4-methoxyphenyl)methyl]-1,2,4-oxadiazol-5-yl}-2-[(1-methyl-1H-pyrazol-4-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
8-{3-[(4-methoxyphenyl)methyl]-1,2,4-oxadiazol-5-yl}-2-[(1-methyl-1H-pyrazol-4-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Compound characteristics
| Compound ID: | SC88-1730 |
| Compound Name: | 8-{3-[(4-methoxyphenyl)methyl]-1,2,4-oxadiazol-5-yl}-2-[(1-methyl-1H-pyrazol-4-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione |
| Molecular Weight: | 443.52 |
| Molecular Formula: | C21 H25 N5 O4 S |
| Smiles: | Cn1cc(CN2CC3(C2)C(CCS3(=O)=O)c2nc(Cc3ccc(cc3)OC)no2)cn1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2344 |
| logD: | 0.3225 |
| logSw: | -2.1189 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 87.73 |
| InChI Key: | FSEFNTYAQMGOGR-SFHVURJKSA-N |