methyl 5-[(5-{[2-(3,5-dichloroanilino)(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-(3,5-dichloroanilino)(oxo)acetamido]methyl}furan-2-yl)methylidene]-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 5-[(5-{[2-(3,5-dichloroanilino)(oxo)acetamido]methyl}furan-2-yl)methylidene]-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 5072-1370 |
| Compound Name: | methyl 5-[(5-{[2-(3,5-dichloroanilino)(oxo)acetamido]methyl}furan-2-yl)methylidene]-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 478.29 |
| Molecular Formula: | C21 H17 Cl2 N3 O6 |
| Smiles: | CC1=C(C(/C(=C\c2ccc(CNC(C(Nc3cc(cc(c3)[Cl])[Cl])=O)=O)o2)N1)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.9731 |
| logD: | 1.145 |
| logSw: | -4.3253 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 100.272 |
| InChI Key: | RJDGRRQIWLPQAW-UHFFFAOYSA-N |