N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamide
Compound characteristics
| Compound ID: | E645-0051 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamide |
| Molecular Weight: | 433.46 |
| Molecular Formula: | C24 H23 N3 O5 |
| Smiles: | COc1ccc(CCNC(CN2C(c3cccnc3Oc3ccccc23)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.0471 |
| logD: | 2.0471 |
| logSw: | -3.021 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.106 |
| InChI Key: | DEWVIAGDUFWITG-UHFFFAOYSA-N |