3-{3-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-3-oxopropyl}-7,8-dimethoxy-1,3-dihydro-2H-3-benzazepin-2-one
Chemical Structure Depiction of
3-{3-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-3-oxopropyl}-7,8-dimethoxy-1,3-dihydro-2H-3-benzazepin-2-one
3-{3-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-3-oxopropyl}-7,8-dimethoxy-1,3-dihydro-2H-3-benzazepin-2-one
Compound characteristics
| Compound ID: | IB07-6338 |
| Compound Name: | 3-{3-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-3-oxopropyl}-7,8-dimethoxy-1,3-dihydro-2H-3-benzazepin-2-one |
| Molecular Weight: | 484.98 |
| Molecular Formula: | C26 H29 Cl N2 O5 |
| Smiles: | COc1cc2CC(N(CCC(N3CCC(CC3)(c3ccc(cc3)[Cl])O)=O)C=Cc2cc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.98 |
| logD: | 1.98 |
| logSw: | -2.73 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 129.81 |
| InChI Key: | GLKUXMCEXPEDFH-UHFFFAOYSA-N |