2-methyl-1-[(3S)-3-methyl-7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]propan-1-one
Chemical Structure Depiction of
2-methyl-1-[(3S)-3-methyl-7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]propan-1-one
2-methyl-1-[(3S)-3-methyl-7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]propan-1-one
Compound characteristics
| Compound ID: | S978-0260 |
| Compound Name: | 2-methyl-1-[(3S)-3-methyl-7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]propan-1-one |
| Molecular Weight: | 332.44 |
| Molecular Formula: | C19 H28 N2 O3 |
| Smiles: | CC(C)C(N1Cc2cc(CN3CCOCC3)ccc2OC[C@@H]1C)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.349 |
| logD: | 2.287 |
| logSw: | -2.7053 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.527 |
| InChI Key: | IQNHVTIFPZUYSD-HNNXBMFYSA-N |