4-oxo-N-[(pyridin-3-yl)methyl]-4-(pyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)butanamide
Chemical Structure Depiction of
4-oxo-N-[(pyridin-3-yl)methyl]-4-(pyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)butanamide
4-oxo-N-[(pyridin-3-yl)methyl]-4-(pyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)butanamide
Compound characteristics
| Compound ID: | E986-0014 |
| Compound Name: | 4-oxo-N-[(pyridin-3-yl)methyl]-4-(pyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)butanamide |
| Molecular Weight: | 388.42 |
| Molecular Formula: | C22 H20 N4 O3 |
| Smiles: | C(CC(N1Cc2ccccc2Oc2c1cccn2)=O)C(NCc1cccnc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8643 |
| logD: | 1.8619 |
| logSw: | -1.7479 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.138 |
| InChI Key: | SATQOAYKUUJPRF-UHFFFAOYSA-N |