6-{2-[4-(dimethylamino)phenyl]-4-hydroxy-5-oxo-3-(3-phenylprop-2-enoyl)-2,5-dihydro-1H-pyrrol-1-yl}hexanoic acid
Chemical Structure Depiction of
6-{2-[4-(dimethylamino)phenyl]-4-hydroxy-5-oxo-3-(3-phenylprop-2-enoyl)-2,5-dihydro-1H-pyrrol-1-yl}hexanoic acid
6-{2-[4-(dimethylamino)phenyl]-4-hydroxy-5-oxo-3-(3-phenylprop-2-enoyl)-2,5-dihydro-1H-pyrrol-1-yl}hexanoic acid
Compound characteristics
| Compound ID: | 4393-0090 |
| Compound Name: | 6-{2-[4-(dimethylamino)phenyl]-4-hydroxy-5-oxo-3-(3-phenylprop-2-enoyl)-2,5-dihydro-1H-pyrrol-1-yl}hexanoic acid |
| Molecular Weight: | 462.55 |
| Molecular Formula: | C27 H30 N2 O5 |
| Smiles: | CN(C)c1ccc(cc1)C1C(=C(C(N1CCCCCC(O)=O)=O)O)C(/C=C/c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4465 |
| logD: | 0.6183 |
| logSw: | -3.5643 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.774 |
| InChI Key: | IXWNRIHLPTUFGU-VWLOTQADSA-N |