2-[(2,3-dimethylanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione
Chemical Structure Depiction of
2-[(2,3-dimethylanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione
2-[(2,3-dimethylanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione
Compound characteristics
Compound ID: | 2104-0028 |
Compound Name: | 2-[(2,3-dimethylanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione |
Molecular Weight: | 271.36 |
Molecular Formula: | C17 H21 N O2 |
Smiles: | Cc1cccc(c1C)NC=C1C(CC(C)(C)CC1=O)=O |
Stereo: | ACHIRAL |
logP: | 3.4419 |
logD: | 3.4304 |
logSw: | -3.4939 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 37.558 |
InChI Key: | KGAOSBYSBWDMJI-UHFFFAOYSA-N |