2-(benzyloxy)-1-[(3R)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one
Chemical Structure Depiction of
2-(benzyloxy)-1-[(3R)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one
2-(benzyloxy)-1-[(3R)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | SC09-0350 |
| Compound Name: | 2-(benzyloxy)-1-[(3R)-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one |
| Molecular Weight: | 389.45 |
| Molecular Formula: | C23 H23 N3 O3 |
| Smiles: | C[C@@H]1COc2ccc(cc2CN1C(COCc1ccccc1)=O)c1cncnc1 |
| Stereo: | ABSOLUTE |
| logP: | 2.8769 |
| logD: | 2.8769 |
| logSw: | -3.1615 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.999 |
| InChI Key: | ZSFUEBAUTLXRIB-QGZVFWFLSA-N |