2-[(2-amino-5-benzoylanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione
Chemical Structure Depiction of
2-[(2-amino-5-benzoylanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione
2-[(2-amino-5-benzoylanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione
Compound characteristics
| Compound ID: | 4533-0013 |
| Compound Name: | 2-[(2-amino-5-benzoylanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione |
| Molecular Weight: | 362.43 |
| Molecular Formula: | C22 H22 N2 O3 |
| Smiles: | CC1(C)CC(C(=CNc2cc(ccc2N)C(c2ccccc2)=O)C(C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1663 |
| logD: | 2.2534 |
| logSw: | -3.5274 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 71.121 |
| InChI Key: | NDFUUDKIAPGGDK-UHFFFAOYSA-N |