methyl 4-{4-[(3-ethoxy-4-hydroxyphenyl)methylidene]-3,5-dioxopyrazolidin-1-yl}benzoate
Chemical Structure Depiction of
methyl 4-{4-[(3-ethoxy-4-hydroxyphenyl)methylidene]-3,5-dioxopyrazolidin-1-yl}benzoate
methyl 4-{4-[(3-ethoxy-4-hydroxyphenyl)methylidene]-3,5-dioxopyrazolidin-1-yl}benzoate
Compound characteristics
| Compound ID: | 3871-0122 |
| Compound Name: | methyl 4-{4-[(3-ethoxy-4-hydroxyphenyl)methylidene]-3,5-dioxopyrazolidin-1-yl}benzoate |
| Molecular Weight: | 382.37 |
| Molecular Formula: | C20 H18 N2 O6 |
| Smiles: | CCOc1cc(\C=C2/C(NN(C2=O)c2ccc(cc2)C(=O)OC)=O)ccc1O |
| Stereo: | ACHIRAL |
| logP: | 2.2519 |
| logD: | 2.1687 |
| logSw: | -2.6206 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.692 |
| InChI Key: | RLQJOYQHDLWGOD-UHFFFAOYSA-N |