3-[(2-chloro-6-fluorophenyl)methyl]-7,8-dimethoxy-1,3-dihydro-2H-3-benzazepin-2-one
Chemical Structure Depiction of
3-[(2-chloro-6-fluorophenyl)methyl]-7,8-dimethoxy-1,3-dihydro-2H-3-benzazepin-2-one
3-[(2-chloro-6-fluorophenyl)methyl]-7,8-dimethoxy-1,3-dihydro-2H-3-benzazepin-2-one
Compound characteristics
| Compound ID: | Y041-7444 |
| Compound Name: | 3-[(2-chloro-6-fluorophenyl)methyl]-7,8-dimethoxy-1,3-dihydro-2H-3-benzazepin-2-one |
| Molecular Weight: | 361.8 |
| Molecular Formula: | C19 H17 Cl F N O3 |
| Smiles: | COc1cc2CC(N(Cc3c(cccc3[Cl])F)C=Cc2cc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0263 |
| logD: | 3.0263 |
| logSw: | -3.4035 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.5508 |
| InChI Key: | PINMSMYTSOKQTE-UHFFFAOYSA-N |