2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-propylacetamide
Chemical Structure Depiction of
2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-propylacetamide
2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-propylacetamide
Compound characteristics
| Compound ID: | E645-0076 |
| Compound Name: | 2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-propylacetamide |
| Molecular Weight: | 311.34 |
| Molecular Formula: | C17 H17 N3 O3 |
| Smiles: | CCCNC(CN1C(c2cccnc2Oc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8223 |
| logD: | 1.8223 |
| logSw: | -2.6795 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.117 |
| InChI Key: | QSRQZOKEJDAMGS-UHFFFAOYSA-N |