4-(4-bromobenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(prop-2-en-1-yl)-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
4-(4-bromobenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(prop-2-en-1-yl)-1,5-dihydro-2H-pyrrol-2-one
4-(4-bromobenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(prop-2-en-1-yl)-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | 3042-4928 |
| Compound Name: | 4-(4-bromobenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(prop-2-en-1-yl)-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 458.31 |
| Molecular Formula: | C22 H20 Br N O5 |
| Smiles: | COc1ccc(cc1OC)C1C(=C(C(N1CC=C)=O)O)C(c1ccc(cc1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7597 |
| logD: | 3.7557 |
| logSw: | -3.9697 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.338 |
| InChI Key: | XIYANVHPBFQKEI-LJQANCHMSA-N |