2-cyclopropyl-1-[(3S)-3-methyl-7-(morpholine-4-carbonyl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one
Chemical Structure Depiction of
2-cyclopropyl-1-[(3S)-3-methyl-7-(morpholine-4-carbonyl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one
2-cyclopropyl-1-[(3S)-3-methyl-7-(morpholine-4-carbonyl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | S979-0470 |
| Compound Name: | 2-cyclopropyl-1-[(3S)-3-methyl-7-(morpholine-4-carbonyl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one |
| Molecular Weight: | 358.44 |
| Molecular Formula: | C20 H26 N2 O4 |
| Smiles: | C[C@H]1COc2ccc(cc2CN1C(CC1CC1)=O)C(N1CCOCC1)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.6913 |
| logD: | 1.6913 |
| logSw: | -2.2504 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.167 |
| InChI Key: | MBOHKCUZHRGQKR-CQSZACIVSA-N |