4-{4-hydroxy-1-[(3-methoxyphenyl)methyl]-5-oxo-3-phenyl-2,5-dihydro-1H-pyrrol-2-yl}benzoic acid
Chemical Structure Depiction of
4-{4-hydroxy-1-[(3-methoxyphenyl)methyl]-5-oxo-3-phenyl-2,5-dihydro-1H-pyrrol-2-yl}benzoic acid
4-{4-hydroxy-1-[(3-methoxyphenyl)methyl]-5-oxo-3-phenyl-2,5-dihydro-1H-pyrrol-2-yl}benzoic acid
Compound characteristics
| Compound ID: | F455-0397 |
| Compound Name: | 4-{4-hydroxy-1-[(3-methoxyphenyl)methyl]-5-oxo-3-phenyl-2,5-dihydro-1H-pyrrol-2-yl}benzoic acid |
| Molecular Weight: | 415.44 |
| Molecular Formula: | C25 H21 N O5 |
| Smiles: | COc1cccc(CN2C(C(=C(C2=O)O)c2ccccc2)c2ccc(cc2)C(O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1197 |
| logD: | 1.1482 |
| logSw: | -4.2979 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.04 |
| InChI Key: | KLTMMEBCUREELU-QFIPXVFZSA-N |