4-(4-bromobenzoyl)-1-(5-tert-butyl-1,2-oxazol-3-yl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
4-(4-bromobenzoyl)-1-(5-tert-butyl-1,2-oxazol-3-yl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
4-(4-bromobenzoyl)-1-(5-tert-butyl-1,2-oxazol-3-yl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | 4530-7226 |
| Compound Name: | 4-(4-bromobenzoyl)-1-(5-tert-butyl-1,2-oxazol-3-yl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 541.4 |
| Molecular Formula: | C26 H25 Br N2 O6 |
| Smiles: | CC(C)(C)c1cc(no1)N1C(C(=C(C1=O)O)C(c1ccc(cc1)[Br])=O)c1ccc(c(c1)OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2881 |
| logD: | 5.2846 |
| logSw: | -5.2714 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.746 |
| InChI Key: | AESVAWGOAHQLGM-JOCHJYFZSA-N |