N-[(2-chlorophenyl)methyl]-4-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)butanamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-4-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)butanamide
N-[(2-chlorophenyl)methyl]-4-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)butanamide
Compound characteristics
| Compound ID: | E645-1875 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-4-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)butanamide |
| Molecular Weight: | 421.88 |
| Molecular Formula: | C23 H20 Cl N3 O3 |
| Smiles: | C(CC(NCc1ccccc1[Cl])=O)CN1C(c2cccnc2Oc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4832 |
| logD: | 3.4832 |
| logSw: | -3.9028 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.982 |
| InChI Key: | VYFSMBBUVWOFKM-UHFFFAOYSA-N |