6-{3-hydroxy-2-oxo-4-(3-phenylprop-2-enoyl)-5-[4-(propan-2-yl)phenyl]-2,5-dihydro-1H-pyrrol-1-yl}hexanoic acid
Chemical Structure Depiction of
6-{3-hydroxy-2-oxo-4-(3-phenylprop-2-enoyl)-5-[4-(propan-2-yl)phenyl]-2,5-dihydro-1H-pyrrol-1-yl}hexanoic acid
6-{3-hydroxy-2-oxo-4-(3-phenylprop-2-enoyl)-5-[4-(propan-2-yl)phenyl]-2,5-dihydro-1H-pyrrol-1-yl}hexanoic acid
Compound characteristics
| Compound ID: | 4393-0089 |
| Compound Name: | 6-{3-hydroxy-2-oxo-4-(3-phenylprop-2-enoyl)-5-[4-(propan-2-yl)phenyl]-2,5-dihydro-1H-pyrrol-1-yl}hexanoic acid |
| Molecular Weight: | 461.56 |
| Molecular Formula: | C28 H31 N O5 |
| Smiles: | CC(C)c1ccc(cc1)C1C(=C(C(N1CCCCCC(O)=O)=O)O)C(/C=C/c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6947 |
| logD: | 1.8665 |
| logSw: | -4.2347 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.969 |
| InChI Key: | ZTURBYIPSSLUDZ-SANMLTNESA-N |