5-(4-ethylphenyl)-3-hydroxy-4-(4-methylbenzoyl)-1-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
5-(4-ethylphenyl)-3-hydroxy-4-(4-methylbenzoyl)-1-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]-1,5-dihydro-2H-pyrrol-2-one
5-(4-ethylphenyl)-3-hydroxy-4-(4-methylbenzoyl)-1-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | Y070-2947 |
| Compound Name: | 5-(4-ethylphenyl)-3-hydroxy-4-(4-methylbenzoyl)-1-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 479.62 |
| Molecular Formula: | C25 H25 N3 O3 S2 |
| Smiles: | CCCSc1nnc(N2C(C(=C(C2=O)O)C(c2ccc(C)cc2)=O)c2ccc(CC)cc2)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8866 |
| logD: | 5.8379 |
| logSw: | -5.3993 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.895 |
| InChI Key: | URFFAONQQJLCFI-HXUWFJFHSA-N |