N-(3-chloro-2-methylphenyl)-2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamide
N-(3-chloro-2-methylphenyl)-2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamide
Compound characteristics
| Compound ID: | E645-0070 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamide |
| Molecular Weight: | 393.83 |
| Molecular Formula: | C21 H16 Cl N3 O3 |
| Smiles: | Cc1c(cccc1[Cl])NC(CN1C(c2cccnc2Oc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9849 |
| logD: | 3.9847 |
| logSw: | -4.3352 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.984 |
| InChI Key: | YPOOYEDPIYWZBS-UHFFFAOYSA-N |