methyl 5-[(5-{[2-(3,4-dimethylanilino)(oxo)acetamido]methyl}furan-2-yl)methylidene]-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 5-[(5-{[2-(3,4-dimethylanilino)(oxo)acetamido]methyl}furan-2-yl)methylidene]-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 5-[(5-{[2-(3,4-dimethylanilino)(oxo)acetamido]methyl}furan-2-yl)methylidene]-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 5072-1369 |
| Compound Name: | methyl 5-[(5-{[2-(3,4-dimethylanilino)(oxo)acetamido]methyl}furan-2-yl)methylidene]-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 437.45 |
| Molecular Formula: | C23 H23 N3 O6 |
| Smiles: | CC1=C(C(/C(=C\c2ccc(CNC(C(Nc3ccc(C)c(C)c3)=O)=O)o2)N1)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.4301 |
| logD: | 3.3877 |
| logSw: | -3.5523 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 100.272 |
| InChI Key: | ZOJYRJRQXGLFOL-UHFFFAOYSA-N |