1-(3,4-dimethylphenyl)-4-{[5-(1-oxo-1,3-dihydro-2-benzofuran-5-yl)furan-2-yl]methylidene}pyrazolidine-3,5-dione
Chemical Structure Depiction of
1-(3,4-dimethylphenyl)-4-{[5-(1-oxo-1,3-dihydro-2-benzofuran-5-yl)furan-2-yl]methylidene}pyrazolidine-3,5-dione
1-(3,4-dimethylphenyl)-4-{[5-(1-oxo-1,3-dihydro-2-benzofuran-5-yl)furan-2-yl]methylidene}pyrazolidine-3,5-dione
Compound characteristics
| Compound ID: | 3697-0125 |
| Compound Name: | 1-(3,4-dimethylphenyl)-4-{[5-(1-oxo-1,3-dihydro-2-benzofuran-5-yl)furan-2-yl]methylidene}pyrazolidine-3,5-dione |
| Molecular Weight: | 414.42 |
| Molecular Formula: | C24 H18 N2 O5 |
| Smiles: | Cc1ccc(cc1C)N1C(C(=C/c2ccc(c3ccc4C(=O)OCc4c3)o2)\C(N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0704 |
| logD: | 3.8286 |
| logSw: | -4.2611 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.902 |
| InChI Key: | ZJEXVMOQINXUOF-UHFFFAOYSA-N |