methyl 4-[(5-{[2-(3,4-dimethylanilino)(oxo)acetamido]methyl}furan-2-yl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 4-[(5-{[2-(3,4-dimethylanilino)(oxo)acetamido]methyl}furan-2-yl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 4-[(5-{[2-(3,4-dimethylanilino)(oxo)acetamido]methyl}furan-2-yl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 5641-0870 |
| Compound Name: | methyl 4-[(5-{[2-(3,4-dimethylanilino)(oxo)acetamido]methyl}furan-2-yl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 437.45 |
| Molecular Formula: | C23 H23 N3 O6 |
| Smiles: | CC1=C(/C(=C\c2ccc(CNC(C(Nc3ccc(C)c(C)c3)=O)=O)o2)C(N1)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.0018 |
| logD: | 2.7697 |
| logSw: | -3.2476 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 100.824 |
| InChI Key: | NLBLHZSHUAFIJA-UHFFFAOYSA-N |