N-[2-(cyclohex-1-en-1-yl)ethyl]-4-(10-methoxypyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)-4-oxobutanamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-4-(10-methoxypyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)-4-oxobutanamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-4-(10-methoxypyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)-4-oxobutanamide
Compound characteristics
| Compound ID: | E986-0889 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-4-(10-methoxypyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)-4-oxobutanamide |
| Molecular Weight: | 435.52 |
| Molecular Formula: | C25 H29 N3 O4 |
| Smiles: | COc1cccc2CN(C(CCC(NCCC3CCCCC=3)=O)=O)c3cccnc3Oc12 |
| Stereo: | ACHIRAL |
| logP: | 3.0481 |
| logD: | 3.0481 |
| logSw: | -3.379 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.968 |
| InChI Key: | PBNVKUSEZRZRLW-UHFFFAOYSA-N |