3-(4-aminoanilino)-2-benzoyl-5,5-dimethylcyclohex-2-en-1-one
Chemical Structure Depiction of
3-(4-aminoanilino)-2-benzoyl-5,5-dimethylcyclohex-2-en-1-one
3-(4-aminoanilino)-2-benzoyl-5,5-dimethylcyclohex-2-en-1-one
Compound characteristics
| Compound ID: | 8014-5448 |
| Compound Name: | 3-(4-aminoanilino)-2-benzoyl-5,5-dimethylcyclohex-2-en-1-one |
| Molecular Weight: | 334.42 |
| Molecular Formula: | C21 H22 N2 O2 |
| Smiles: | CC1(C)CC(=C(C(C1)=O)C(c1ccccc1)=O)Nc1ccc(cc1)N |
| Stereo: | ACHIRAL |
| logP: | 3.3346 |
| logD: | 3.1981 |
| logSw: | -3.667 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 56.673 |
| InChI Key: | ULKLBRXOSHIMET-UHFFFAOYSA-N |