4-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-(3-ethoxypropyl)butanamide
Chemical Structure Depiction of
4-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-(3-ethoxypropyl)butanamide
4-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-(3-ethoxypropyl)butanamide
Compound characteristics
| Compound ID: | E645-2550 |
| Compound Name: | 4-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-(3-ethoxypropyl)butanamide |
| Molecular Weight: | 417.89 |
| Molecular Formula: | C21 H24 Cl N3 O4 |
| Smiles: | CCOCCCNC(CCCN1C(c2cccnc2Oc2ccc(cc12)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1538 |
| logD: | 2.1538 |
| logSw: | -3.33 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.072 |
| InChI Key: | PDMZDLOEEGRQSV-UHFFFAOYSA-N |