6-[3-(4-bromobenzoyl)-4-hydroxy-2-(4-methoxyphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]hexanoic acid
Chemical Structure Depiction of
6-[3-(4-bromobenzoyl)-4-hydroxy-2-(4-methoxyphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]hexanoic acid
6-[3-(4-bromobenzoyl)-4-hydroxy-2-(4-methoxyphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]hexanoic acid
Compound characteristics
| Compound ID: | 8009-7002 |
| Compound Name: | 6-[3-(4-bromobenzoyl)-4-hydroxy-2-(4-methoxyphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]hexanoic acid |
| Molecular Weight: | 502.36 |
| Molecular Formula: | C24 H24 Br N O6 |
| Smiles: | COc1ccc(cc1)C1C(=C(C(N1CCCCCC(O)=O)=O)O)C(c1ccc(cc1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6999 |
| logD: | 0.8717 |
| logSw: | -3.7933 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.004 |
| InChI Key: | KQLRVPZBINWVJQ-OAQYLSRUSA-N |