N-[1-(adamantan-1-yl)ethyl]-2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamide
Chemical Structure Depiction of
N-[1-(adamantan-1-yl)ethyl]-2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamide
N-[1-(adamantan-1-yl)ethyl]-2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamide
Compound characteristics
| Compound ID: | E645-0157 |
| Compound Name: | N-[1-(adamantan-1-yl)ethyl]-2-(5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)acetamide |
| Molecular Weight: | 431.53 |
| Molecular Formula: | C26 H29 N3 O3 |
| Smiles: | CC(C12CC3CC(CC(C3)C2)C1)NC(CN1C(c2cccnc2Oc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2757 |
| logD: | 4.2757 |
| logSw: | -4.3859 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.2 |
| InChI Key: | IJBBWRBBPDYCRU-BTVKBFDZSA-N |