(3-fluoro-4-methoxyphenyl)[rel-(5aR,9aR)-1-methyloctahydropyrido[3,4-e][1,4]oxazepin-8(1H)-yl]methanone
Chemical Structure Depiction of
(3-fluoro-4-methoxyphenyl)[rel-(5aR,9aR)-1-methyloctahydropyrido[3,4-e][1,4]oxazepin-8(1H)-yl]methanone
(3-fluoro-4-methoxyphenyl)[rel-(5aR,9aR)-1-methyloctahydropyrido[3,4-e][1,4]oxazepin-8(1H)-yl]methanone
Compound characteristics
| Compound ID: | S232-1557 |
| Compound Name: | (3-fluoro-4-methoxyphenyl)[rel-(5aR,9aR)-1-methyloctahydropyrido[3,4-e][1,4]oxazepin-8(1H)-yl]methanone |
| Molecular Weight: | 322.38 |
| Molecular Formula: | C17 H23 F N2 O3 |
| Smiles: | CN1CCOC[C@H]2CCN(C[C@@H]12)C(c1ccc(c(c1)F)OC)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.0339 |
| logD: | 0.9034 |
| logSw: | -1.9398 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.091 |
| InChI Key: | UOSJSUPYNIDBTP-HIFRSBDPSA-N |