4-(4-chlorobenzoyl)-3-hydroxy-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
4-(4-chlorobenzoyl)-3-hydroxy-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
4-(4-chlorobenzoyl)-3-hydroxy-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: | 4340-2798 |
| Compound Name: | 4-(4-chlorobenzoyl)-3-hydroxy-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: | 467.93 |
| Molecular Formula: | C23 H18 Cl N3 O4 S |
| Smiles: | Cc1nnc(N2C(C(=C(C2=O)O)C(c2ccc(cc2)[Cl])=O)c2ccc(cc2)OCC=C)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9683 |
| logD: | 3.9196 |
| logSw: | -4.546 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.758 |
| InChI Key: | YIIICWILLGSJLD-LJQANCHMSA-N |