2-[(4-methoxyanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione
Chemical Structure Depiction of
2-[(4-methoxyanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione
2-[(4-methoxyanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione
Compound characteristics
| Compound ID: | 4466-0278 |
| Compound Name: | 2-[(4-methoxyanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione |
| Molecular Weight: | 273.33 |
| Molecular Formula: | C16 H19 N O3 |
| Smiles: | CC1(C)CC(C(=CNc2ccc(cc2)OC)C(C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5669 |
| logD: | 2.5435 |
| logSw: | -2.7869 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.799 |
| InChI Key: | QWRSBSOYNCGEOK-UHFFFAOYSA-N |