(furan-2-yl)[rel-(5aR,9aR)-1-[(pyridin-3-yl)methyl]octahydropyrido[3,4-e][1,4]oxazepin-8(1H)-yl]methanone
Chemical Structure Depiction of
(furan-2-yl)[rel-(5aR,9aR)-1-[(pyridin-3-yl)methyl]octahydropyrido[3,4-e][1,4]oxazepin-8(1H)-yl]methanone
(furan-2-yl)[rel-(5aR,9aR)-1-[(pyridin-3-yl)methyl]octahydropyrido[3,4-e][1,4]oxazepin-8(1H)-yl]methanone
Compound characteristics
| Compound ID: | S232-1880 |
| Compound Name: | (furan-2-yl)[rel-(5aR,9aR)-1-[(pyridin-3-yl)methyl]octahydropyrido[3,4-e][1,4]oxazepin-8(1H)-yl]methanone |
| Molecular Weight: | 341.41 |
| Molecular Formula: | C19 H23 N3 O3 |
| Smiles: | C1CN(C[C@@H]2[C@H]1COCCN2Cc1cccnc1)C(c1ccco1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.8507 |
| logD: | 0.8433 |
| logSw: | -0.5864 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.57 |
| InChI Key: | WUWVYAYRSZJKEY-SJORKVTESA-N |