N-(2,4-dimethoxyphenyl)-2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamide
Chemical Structure Depiction of
N-(2,4-dimethoxyphenyl)-2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamide
N-(2,4-dimethoxyphenyl)-2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamide
Compound characteristics
| Compound ID: | E645-0049 |
| Compound Name: | N-(2,4-dimethoxyphenyl)-2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamide |
| Molecular Weight: | 405.41 |
| Molecular Formula: | C22 H19 N3 O5 |
| Smiles: | COc1ccc(c(c1)OC)NC(CN1C(c2cccnc2Oc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9228 |
| logD: | 2.9227 |
| logSw: | -3.5725 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.158 |
| InChI Key: | KRRATLBGMFJJFY-UHFFFAOYSA-N |