methyl 4-{3-[(4-nitrophenyl)methylidene]-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl}benzoate
Chemical Structure Depiction of
methyl 4-{3-[(4-nitrophenyl)methylidene]-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl}benzoate
methyl 4-{3-[(4-nitrophenyl)methylidene]-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl}benzoate
Compound characteristics
| Compound ID: | 2150-0367 |
| Compound Name: | methyl 4-{3-[(4-nitrophenyl)methylidene]-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl}benzoate |
| Molecular Weight: | 426.43 |
| Molecular Formula: | C25 H18 N2 O5 |
| Smiles: | COC(c1ccc(cc1)N1C(=C/C(=C\c2ccc(cc2)[N+]([O-])=O)C1=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1737 |
| logD: | 5.1737 |
| logSw: | -5.2761 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.603 |
| InChI Key: | QFNXEGZBWNETIS-UHFFFAOYSA-N |