2-(3-methylphenyl)-1-[7-(morpholin-4-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one
Chemical Structure Depiction of
2-(3-methylphenyl)-1-[7-(morpholin-4-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one
2-(3-methylphenyl)-1-[7-(morpholin-4-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | S555-0115 |
| Compound Name: | 2-(3-methylphenyl)-1-[7-(morpholin-4-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one |
| Molecular Weight: | 366.46 |
| Molecular Formula: | C22 H26 N2 O3 |
| Smiles: | Cc1cccc(CC(N2CCOc3ccc(cc3C2)N2CCOCC2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.4036 |
| logD: | 3.4034 |
| logSw: | -3.4016 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 35.665 |
| InChI Key: | BPCMEQYZTVOLHB-UHFFFAOYSA-N |