2-(cyclopent-3-ene-1-carbonyl)-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-(cyclopent-3-ene-1-carbonyl)-8-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
2-(cyclopent-3-ene-1-carbonyl)-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: | SC88-1670 |
| Compound Name: | 2-(cyclopent-3-ene-1-carbonyl)-8-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione |
| Molecular Weight: | 413.49 |
| Molecular Formula: | C21 H23 N3 O4 S |
| Smiles: | Cc1cccc(c1)c1nc(C2CCS(C23CN(C3)C(C2CC=CC2)=O)(=O)=O)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3323 |
| logD: | 3.3323 |
| logSw: | -3.4989 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 77.861 |
| InChI Key: | BRMQNJCSXYILKP-KRWDZBQOSA-N |