5-[(4-methoxyanilino)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
Chemical Structure Depiction of
5-[(4-methoxyanilino)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
5-[(4-methoxyanilino)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
Compound characteristics
| Compound ID: | K699-0011 |
| Compound Name: | 5-[(4-methoxyanilino)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione |
| Molecular Weight: | 277.27 |
| Molecular Formula: | C14 H15 N O5 |
| Smiles: | CC1(C)OC(C(=CNc2ccc(cc2)OC)C(=O)O1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9415 |
| logD: | 1.8736 |
| logSw: | -2.2619 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.589 |
| InChI Key: | SCHBXLNQEACFDF-UHFFFAOYSA-N |