7,8-dimethoxy-3-{[3-(trifluoromethyl)phenyl]methyl}-1,3-dihydro-2H-3-benzazepin-2-one
Chemical Structure Depiction of
7,8-dimethoxy-3-{[3-(trifluoromethyl)phenyl]methyl}-1,3-dihydro-2H-3-benzazepin-2-one
7,8-dimethoxy-3-{[3-(trifluoromethyl)phenyl]methyl}-1,3-dihydro-2H-3-benzazepin-2-one
Compound characteristics
| Compound ID: | Y042-1247 |
| Compound Name: | 7,8-dimethoxy-3-{[3-(trifluoromethyl)phenyl]methyl}-1,3-dihydro-2H-3-benzazepin-2-one |
| Molecular Weight: | 377.36 |
| Molecular Formula: | C20 H18 F3 N O3 |
| Smiles: | COc1cc2CC(N(Cc3cccc(c3)C(F)(F)F)C=Cc2cc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9939 |
| logD: | 2.9939 |
| logSw: | -3.2946 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.5508 |
| InChI Key: | IFJVXOZCIQJZQG-UHFFFAOYSA-N |