3-(8-methyl-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-({4-[(propan-2-yl)oxy]phenyl}methyl)propanamide
Chemical Structure Depiction of
3-(8-methyl-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-({4-[(propan-2-yl)oxy]phenyl}methyl)propanamide
3-(8-methyl-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-({4-[(propan-2-yl)oxy]phenyl}methyl)propanamide
Compound characteristics
| Compound ID: | E645-1442 |
| Compound Name: | 3-(8-methyl-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-({4-[(propan-2-yl)oxy]phenyl}methyl)propanamide |
| Molecular Weight: | 445.52 |
| Molecular Formula: | C26 H27 N3 O4 |
| Smiles: | CC(C)Oc1ccc(CNC(CCN2C(c3cccnc3Oc3ccc(C)cc23)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1117 |
| logD: | 4.1117 |
| logSw: | -4.1672 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.785 |
| InChI Key: | KKFLNEKSDBRKCX-UHFFFAOYSA-N |