1-(1,3-benzothiazol-2-yl)-4-benzoyl-3-hydroxy-5-[4-(propan-2-yl)phenyl]-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
1-(1,3-benzothiazol-2-yl)-4-benzoyl-3-hydroxy-5-[4-(propan-2-yl)phenyl]-1,5-dihydro-2H-pyrrol-2-one
1-(1,3-benzothiazol-2-yl)-4-benzoyl-3-hydroxy-5-[4-(propan-2-yl)phenyl]-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | 8010-5687 |
| Compound Name: | 1-(1,3-benzothiazol-2-yl)-4-benzoyl-3-hydroxy-5-[4-(propan-2-yl)phenyl]-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 454.55 |
| Molecular Formula: | C27 H22 N2 O3 S |
| Smiles: | CC(C)c1ccc(cc1)C1C(=C(C(N1c1nc2ccccc2s1)=O)O)C(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.187 |
| logD: | 6.0446 |
| logSw: | -5.6368 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.751 |
| InChI Key: | KAQVILSKLACVST-HSZRJFAPSA-N |