1-{3-[benzyl(oxan-4-yl)amino]azetidin-1-yl}-2-(3,4-dimethoxyphenyl)ethan-1-one
Chemical Structure Depiction of
1-{3-[benzyl(oxan-4-yl)amino]azetidin-1-yl}-2-(3,4-dimethoxyphenyl)ethan-1-one
1-{3-[benzyl(oxan-4-yl)amino]azetidin-1-yl}-2-(3,4-dimethoxyphenyl)ethan-1-one
Compound characteristics
| Compound ID: | S591-0484 |
| Compound Name: | 1-{3-[benzyl(oxan-4-yl)amino]azetidin-1-yl}-2-(3,4-dimethoxyphenyl)ethan-1-one |
| Molecular Weight: | 424.54 |
| Molecular Formula: | C25 H32 N2 O4 |
| Smiles: | COc1ccc(CC(N2CC(C2)N(Cc2ccccc2)C2CCOCC2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.9264 |
| logD: | 2.2044 |
| logSw: | -3.1684 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.356 |
| InChI Key: | FBFDHROOKNWACQ-UHFFFAOYSA-N |