1-[(3S)-3-methyl-7-(pyridin-3-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one
Chemical Structure Depiction of
1-[(3S)-3-methyl-7-(pyridin-3-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one
1-[(3S)-3-methyl-7-(pyridin-3-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | SC09-0562 |
| Compound Name: | 1-[(3S)-3-methyl-7-(pyridin-3-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one |
| Molecular Weight: | 282.34 |
| Molecular Formula: | C17 H18 N2 O2 |
| Smiles: | CC(N1Cc2cc(ccc2OC[C@@H]1C)c1cccnc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.3976 |
| logD: | 2.3907 |
| logSw: | -2.3591 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.6 |
| InChI Key: | YZVDQNSUOWHBHJ-LBPRGKRZSA-N |