3-{[2-(1H-benzimidazol-2-yl)ethyl]amino}-2-benzoyl-5,5-dimethylcyclohex-2-en-1-one
Chemical Structure Depiction of
3-{[2-(1H-benzimidazol-2-yl)ethyl]amino}-2-benzoyl-5,5-dimethylcyclohex-2-en-1-one
3-{[2-(1H-benzimidazol-2-yl)ethyl]amino}-2-benzoyl-5,5-dimethylcyclohex-2-en-1-one
Compound characteristics
| Compound ID: | 8016-2391 |
| Compound Name: | 3-{[2-(1H-benzimidazol-2-yl)ethyl]amino}-2-benzoyl-5,5-dimethylcyclohex-2-en-1-one |
| Molecular Weight: | 387.48 |
| Molecular Formula: | C24 H25 N3 O2 |
| Smiles: | CC1(C)CC(=C(C(C1)=O)C(c1ccccc1)=O)NCCc1nc2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 3.9704 |
| logD: | 3.9523 |
| logSw: | -4.2403 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.312 |
| InChI Key: | LVGRICFONWQIIB-UHFFFAOYSA-N |