3-hydroxy-4-(4-methylbenzoyl)-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-{4-[(prop-2-en-1-yl)oxy]phenyl}-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
3-hydroxy-4-(4-methylbenzoyl)-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-{4-[(prop-2-en-1-yl)oxy]phenyl}-1,5-dihydro-2H-pyrrol-2-one
3-hydroxy-4-(4-methylbenzoyl)-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-{4-[(prop-2-en-1-yl)oxy]phenyl}-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | 4340-2782 |
| Compound Name: | 3-hydroxy-4-(4-methylbenzoyl)-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-{4-[(prop-2-en-1-yl)oxy]phenyl}-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 447.51 |
| Molecular Formula: | C24 H21 N3 O4 S |
| Smiles: | Cc1ccc(cc1)C(C1C(c2ccc(cc2)OCC=C)N(C(C=1O)=O)c1nnc(C)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.797 |
| logD: | 3.7483 |
| logSw: | -3.8898 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.758 |
| InChI Key: | NOEPGUSWLBDBRC-HXUWFJFHSA-N |