2-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-(2,6-dimethylphenyl)acetamide
Chemical Structure Depiction of
2-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-(2,6-dimethylphenyl)acetamide
2-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-(2,6-dimethylphenyl)acetamide
Compound characteristics
| Compound ID: | E645-0684 |
| Compound Name: | 2-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-(2,6-dimethylphenyl)acetamide |
| Molecular Weight: | 407.86 |
| Molecular Formula: | C22 H18 Cl N3 O3 |
| Smiles: | Cc1cccc(C)c1NC(CN1C(c2cccnc2Oc2ccc(cc12)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9776 |
| logD: | 3.9776 |
| logSw: | -4.3698 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.286 |
| InChI Key: | UYLPCGGZYGRVCD-UHFFFAOYSA-N |