3-hydroxy-5-(4-methoxyphenyl)-1-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(thiophene-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
3-hydroxy-5-(4-methoxyphenyl)-1-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(thiophene-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one
3-hydroxy-5-(4-methoxyphenyl)-1-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(thiophene-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | Y070-5119 |
| Compound Name: | 3-hydroxy-5-(4-methoxyphenyl)-1-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(thiophene-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C19 H15 N3 O4 S3 |
| Smiles: | COc1ccc(cc1)C1C(=C(C(N1c1nnc(SC)s1)=O)O)C(c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6842 |
| logD: | 3.4061 |
| logSw: | -3.9929 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.457 |
| InChI Key: | SKKGDZLMHCLNMV-CQSZACIVSA-N |