methyl 1-(3-bromophenyl)-4-[(2-hydroxyphenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 1-(3-bromophenyl)-4-[(2-hydroxyphenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 1-(3-bromophenyl)-4-[(2-hydroxyphenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4031-2754 |
| Compound Name: | methyl 1-(3-bromophenyl)-4-[(2-hydroxyphenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 414.25 |
| Molecular Formula: | C20 H16 Br N O4 |
| Smiles: | CC1=C(/C(=C/c2ccccc2O)C(N1c1cccc(c1)[Br])=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.8173 |
| logD: | 3.8041 |
| logSw: | -3.5686 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.047 |
| InChI Key: | HSDHMMSCWWWQPQ-UHFFFAOYSA-N |