4-(furan-2-carbonyl)-5-(furan-2-yl)-3-hydroxy-1-(5-{[(4-methylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
4-(furan-2-carbonyl)-5-(furan-2-yl)-3-hydroxy-1-(5-{[(4-methylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
4-(furan-2-carbonyl)-5-(furan-2-yl)-3-hydroxy-1-(5-{[(4-methylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | Y070-4540 |
| Compound Name: | 4-(furan-2-carbonyl)-5-(furan-2-yl)-3-hydroxy-1-(5-{[(4-methylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 479.53 |
| Molecular Formula: | C23 H17 N3 O5 S2 |
| Smiles: | Cc1ccc(CSc2nnc(N3C(C(=C(C3=O)O)C(c3ccco3)=O)c3ccco3)s2)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7019 |
| logD: | 3.4777 |
| logSw: | -3.7944 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.781 |
| InChI Key: | NWEOFUIDTUVTRC-SFHVURJKSA-N |