4-(4-bromobenzoyl)-1-(5-tert-butyl-1,2-oxazol-3-yl)-3-hydroxy-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
4-(4-bromobenzoyl)-1-(5-tert-butyl-1,2-oxazol-3-yl)-3-hydroxy-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
4-(4-bromobenzoyl)-1-(5-tert-butyl-1,2-oxazol-3-yl)-3-hydroxy-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | 4530-7221 |
| Compound Name: | 4-(4-bromobenzoyl)-1-(5-tert-butyl-1,2-oxazol-3-yl)-3-hydroxy-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 526.34 |
| Molecular Formula: | C24 H20 Br N3 O6 |
| Smiles: | CC(C)(C)c1cc(no1)N1C(C(=C(C1=O)O)C(c1ccc(cc1)[Br])=O)c1cccc(c1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4979 |
| logD: | 5.4944 |
| logSw: | -5.2966 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.867 |
| InChI Key: | GPKIBOUVZHBJKU-HXUWFJFHSA-N |