5-(4-tert-butylphenyl)-4-(4-chlorobenzoyl)-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
5-(4-tert-butylphenyl)-4-(4-chlorobenzoyl)-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
5-(4-tert-butylphenyl)-4-(4-chlorobenzoyl)-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | 4340-2787 |
| Compound Name: | 5-(4-tert-butylphenyl)-4-(4-chlorobenzoyl)-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 467.97 |
| Molecular Formula: | C24 H22 Cl N3 O3 S |
| Smiles: | Cc1nnc(N2C(C(=C(C2=O)O)C(c2ccc(cc2)[Cl])=O)c2ccc(cc2)C(C)(C)C)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2297 |
| logD: | 5.1809 |
| logSw: | -5.7317 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.341 |
| InChI Key: | MJKWKUSGCYSRKK-LJQANCHMSA-N |