methyl 1-benzyl-4-[(3-hydroxyphenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 1-benzyl-4-[(3-hydroxyphenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 1-benzyl-4-[(3-hydroxyphenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4031-2355 |
| Compound Name: | methyl 1-benzyl-4-[(3-hydroxyphenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 349.38 |
| Molecular Formula: | C21 H19 N O4 |
| Smiles: | CC1=C(/C(=C/c2cccc(c2)O)C(N1Cc1ccccc1)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.3446 |
| logD: | 3.3428 |
| logSw: | -3.2647 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.727 |
| InChI Key: | YXZZMEVYWAEBFK-UHFFFAOYSA-N |