N-cyclohexyl-4-oxo-4-(pyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)butanamide
Chemical Structure Depiction of
N-cyclohexyl-4-oxo-4-(pyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)butanamide
N-cyclohexyl-4-oxo-4-(pyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)butanamide
Compound characteristics
| Compound ID: | E986-0137 |
| Compound Name: | N-cyclohexyl-4-oxo-4-(pyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)butanamide |
| Molecular Weight: | 379.46 |
| Molecular Formula: | C22 H25 N3 O3 |
| Smiles: | C1CCC(CC1)NC(CCC(N1Cc2ccccc2Oc2c1cccn2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4363 |
| logD: | 3.4363 |
| logSw: | -3.717 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.345 |
| InChI Key: | NERDBEXRQLZKLZ-UHFFFAOYSA-N |