N-{2-ethyl-4-[(4-fluorophenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2-phenoxyacetamide
Chemical Structure Depiction of
N-{2-ethyl-4-[(4-fluorophenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2-phenoxyacetamide
N-{2-ethyl-4-[(4-fluorophenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2-phenoxyacetamide
Compound characteristics
| Compound ID: | V018-3296 |
| Compound Name: | N-{2-ethyl-4-[(4-fluorophenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2-phenoxyacetamide |
| Molecular Weight: | 448.49 |
| Molecular Formula: | C26 H25 F N2 O4 |
| Smiles: | CCC1C(N(Cc2ccc(cc2)F)Cc2cc(ccc2O1)NC(COc1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5716 |
| logD: | 4.5716 |
| logSw: | -4.364 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.152 |
| InChI Key: | QTPMITNCOBEXMQ-QHCPKHFHSA-N |