2-[(3,5-dimethylanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione
Chemical Structure Depiction of
2-[(3,5-dimethylanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione
2-[(3,5-dimethylanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione
Compound characteristics
| Compound ID: | 4533-0004 |
| Compound Name: | 2-[(3,5-dimethylanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione |
| Molecular Weight: | 271.36 |
| Molecular Formula: | C17 H21 N O2 |
| Smiles: | Cc1cc(C)cc(c1)NC=C1C(CC(C)(C)CC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1428 |
| logD: | 3.1379 |
| logSw: | -3.1713 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.256 |
| InChI Key: | XLFONMMJGFTWAO-UHFFFAOYSA-N |