N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(8-methyl-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)butanamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(8-methyl-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)butanamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(8-methyl-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)butanamide
Compound characteristics
| Compound ID: | E645-2192 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(8-methyl-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)butanamide |
| Molecular Weight: | 475.54 |
| Molecular Formula: | C27 H29 N3 O5 |
| Smiles: | Cc1ccc2c(c1)N(CCCC(NCCc1ccc(c(c1)OC)OC)=O)C(c1cccnc1O2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4837 |
| logD: | 2.4837 |
| logSw: | -2.9229 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.084 |
| InChI Key: | MNQZNBKYLDQPFY-UHFFFAOYSA-N |