2-(3-fluoro-4-methylbenzoyl)-8-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-(3-fluoro-4-methylbenzoyl)-8-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione--hydrogen chloride (1/1)
2-(3-fluoro-4-methylbenzoyl)-8-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | SC88-0862 |
| Compound Name: | 2-(3-fluoro-4-methylbenzoyl)-8-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione--hydrogen chloride (1/1) |
| Molecular Weight: | 478.93 |
| Molecular Formula: | C21 H19 F N4 O4 S |
| Salt: | HCl |
| Smiles: | Cc1ccc(cc1F)C(N1CC2(C1)C(CCS2(=O)=O)c1nc(c2ccncc2)no1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4232 |
| logD: | 2.4231 |
| logSw: | -2.5696 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 86.731 |
| InChI Key: | ARZBUUNNDINWEV-MRXNPFEDSA-N |