1-(1,3-benzothiazol-2-yl)-4-(4-chlorobenzoyl)-3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
1-(1,3-benzothiazol-2-yl)-4-(4-chlorobenzoyl)-3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
1-(1,3-benzothiazol-2-yl)-4-(4-chlorobenzoyl)-3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | 4622-8559 |
| Compound Name: | 1-(1,3-benzothiazol-2-yl)-4-(4-chlorobenzoyl)-3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 492.94 |
| Molecular Formula: | C25 H17 Cl N2 O5 S |
| Smiles: | COc1cc(ccc1O)C1C(=C(C(N1c1nc2ccccc2s1)=O)O)C(c1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7944 |
| logD: | 4.6519 |
| logSw: | -4.9069 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.929 |
| InChI Key: | XUGWQKIGTBOVEZ-OAQYLSRUSA-N |