2,6-difluoro-N-{4-[2-(4-fluorophenyl)ethyl]-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide
Chemical Structure Depiction of
2,6-difluoro-N-{4-[2-(4-fluorophenyl)ethyl]-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide
2,6-difluoro-N-{4-[2-(4-fluorophenyl)ethyl]-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide
Compound characteristics
| Compound ID: | V017-4544 |
| Compound Name: | 2,6-difluoro-N-{4-[2-(4-fluorophenyl)ethyl]-2-methyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide |
| Molecular Weight: | 454.45 |
| Molecular Formula: | C25 H21 F3 N2 O3 |
| Smiles: | CC1C(N(CCc2ccc(cc2)F)Cc2cc(ccc2O1)NC(c1c(cccc1F)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4876 |
| logD: | 4.4748 |
| logSw: | -4.4732 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.65 |
| InChI Key: | YTWCRDRVWWQSAB-OAHLLOKOSA-N |