N-(3-chloro-4-methoxyphenyl)-2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamide
N-(3-chloro-4-methoxyphenyl)-2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamide
Compound characteristics
| Compound ID: | E645-0137 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamide |
| Molecular Weight: | 409.83 |
| Molecular Formula: | C21 H16 Cl N3 O4 |
| Smiles: | COc1ccc(cc1[Cl])NC(CN1C(c2cccnc2Oc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6882 |
| logD: | 3.6879 |
| logSw: | -4.0842 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.312 |
| InChI Key: | ZTMILVJJEFAXBB-UHFFFAOYSA-N |