2-[(1-methyl-1H-pyrrol-2-yl)methylidene]-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one
Chemical Structure Depiction of
2-[(1-methyl-1H-pyrrol-2-yl)methylidene]-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one
2-[(1-methyl-1H-pyrrol-2-yl)methylidene]-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one
Compound characteristics
| Compound ID: | Y043-5834 |
| Compound Name: | 2-[(1-methyl-1H-pyrrol-2-yl)methylidene]-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one |
| Molecular Weight: | 297.31 |
| Molecular Formula: | C17 H15 N O4 |
| Smiles: | CC(COc1ccc2C(/C(=C\c3cccn3C)Oc2c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3123 |
| logD: | 2.3123 |
| logSw: | -3.0237 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.095 |
| InChI Key: | XZQXIRPJUKBWDO-UHFFFAOYSA-N |