5-(furan-2-yl)-3-hydroxy-4-(5-methylfuran-2-carbonyl)-1-(5-{[(4-methylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
5-(furan-2-yl)-3-hydroxy-4-(5-methylfuran-2-carbonyl)-1-(5-{[(4-methylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
5-(furan-2-yl)-3-hydroxy-4-(5-methylfuran-2-carbonyl)-1-(5-{[(4-methylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | Y070-3342 |
| Compound Name: | 5-(furan-2-yl)-3-hydroxy-4-(5-methylfuran-2-carbonyl)-1-(5-{[(4-methylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 493.56 |
| Molecular Formula: | C24 H19 N3 O5 S2 |
| Smiles: | Cc1ccc(CSc2nnc(N3C(C(=C(C3=O)O)C(c3ccc(C)o3)=O)c3ccco3)s2)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3075 |
| logD: | 4.0833 |
| logSw: | -4.1819 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.295 |
| InChI Key: | MZWYKYZAUVSLHV-IBGZPJMESA-N |