N-{4-[(3,5-difluorophenyl)methyl]-2-ethyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}cyclopropanecarboxamide
Chemical Structure Depiction of
N-{4-[(3,5-difluorophenyl)methyl]-2-ethyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}cyclopropanecarboxamide
N-{4-[(3,5-difluorophenyl)methyl]-2-ethyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}cyclopropanecarboxamide
Compound characteristics
| Compound ID: | V028-5021 |
| Compound Name: | N-{4-[(3,5-difluorophenyl)methyl]-2-ethyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}cyclopropanecarboxamide |
| Molecular Weight: | 400.42 |
| Molecular Formula: | C22 H22 F2 N2 O3 |
| Smiles: | CCC1C(N(Cc2cc(cc(c2)F)F)Cc2cc(ccc2O1)NC(C1CC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1325 |
| logD: | 4.1325 |
| logSw: | -4.1585 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.389 |
| InChI Key: | FXJFXWJEYBEXEN-IBGZPJMESA-N |