1-[1'-(2-methoxyethyl)-3H-spiro[[1,4]benzoxazepine-2,4'-piperidin]-4(5H)-yl]-2-(2-methyl-1H-imidazol-1-yl)ethan-1-one
Chemical Structure Depiction of
1-[1'-(2-methoxyethyl)-3H-spiro[[1,4]benzoxazepine-2,4'-piperidin]-4(5H)-yl]-2-(2-methyl-1H-imidazol-1-yl)ethan-1-one
1-[1'-(2-methoxyethyl)-3H-spiro[[1,4]benzoxazepine-2,4'-piperidin]-4(5H)-yl]-2-(2-methyl-1H-imidazol-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | CM3852-6554 |
| Compound Name: | 1-[1'-(2-methoxyethyl)-3H-spiro[[1,4]benzoxazepine-2,4'-piperidin]-4(5H)-yl]-2-(2-methyl-1H-imidazol-1-yl)ethan-1-one |
| Molecular Weight: | 398.5 |
| Molecular Formula: | C22 H30 N4 O3 |
| Smiles: | Cc1nccn1CC(N1Cc2ccccc2OC2(CCN(CC2)CCOC)C1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1435 |
| logD: | -0.3239 |
| logSw: | -1.8962 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.792 |
| InChI Key: | DUPOYMLYVUGCMO-UHFFFAOYSA-N |