2-(7,8-dimethoxy-2-oxo-1,2-dihydro-3H-3-benzazepin-3-yl)-N-{2-[2-(trifluoromethyl)-1H-benzimidazol-1-yl]ethyl}acetamide
Chemical Structure Depiction of
2-(7,8-dimethoxy-2-oxo-1,2-dihydro-3H-3-benzazepin-3-yl)-N-{2-[2-(trifluoromethyl)-1H-benzimidazol-1-yl]ethyl}acetamide
2-(7,8-dimethoxy-2-oxo-1,2-dihydro-3H-3-benzazepin-3-yl)-N-{2-[2-(trifluoromethyl)-1H-benzimidazol-1-yl]ethyl}acetamide
Compound characteristics
| Compound ID: | Y042-1432 |
| Compound Name: | 2-(7,8-dimethoxy-2-oxo-1,2-dihydro-3H-3-benzazepin-3-yl)-N-{2-[2-(trifluoromethyl)-1H-benzimidazol-1-yl]ethyl}acetamide |
| Molecular Weight: | 488.47 |
| Molecular Formula: | C24 H23 F3 N4 O4 |
| Smiles: | COc1cc2CC(N(CC(NCCn3c4ccccc4nc3C(F)(F)F)=O)C=Cc2cc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3586 |
| logD: | 2.3586 |
| logSw: | -3.0108 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.042 |
| InChI Key: | JELWOPQIARCDIA-UHFFFAOYSA-N |