methyl 1-(3,5-dimethylphenyl)-5-[(4-hydroxyphenyl)methylidene]-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 1-(3,5-dimethylphenyl)-5-[(4-hydroxyphenyl)methylidene]-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 1-(3,5-dimethylphenyl)-5-[(4-hydroxyphenyl)methylidene]-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4031-2350 |
| Compound Name: | methyl 1-(3,5-dimethylphenyl)-5-[(4-hydroxyphenyl)methylidene]-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 363.41 |
| Molecular Formula: | C22 H21 N O4 |
| Smiles: | CC1=C(C(/C(=C\c2ccc(cc2)O)N1c1cc(C)cc(C)c1)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.1331 |
| logD: | 4.117 |
| logSw: | -4.2512 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.028 |
| InChI Key: | BNTTYXJVGBFOOR-UHFFFAOYSA-N |