N-{2-ethyl-4-[(4-fluorophenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2,4-dimethoxybenzamide
Chemical Structure Depiction of
N-{2-ethyl-4-[(4-fluorophenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2,4-dimethoxybenzamide
N-{2-ethyl-4-[(4-fluorophenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | V028-8397 |
| Compound Name: | N-{2-ethyl-4-[(4-fluorophenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-2,4-dimethoxybenzamide |
| Molecular Weight: | 478.52 |
| Molecular Formula: | C27 H27 F N2 O5 |
| Smiles: | CCC1C(N(Cc2ccc(cc2)F)Cc2cc(ccc2O1)NC(c1ccc(cc1OC)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5904 |
| logD: | 4.5888 |
| logSw: | -4.4317 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.041 |
| InChI Key: | LRLJXYSDFMWPSY-QHCPKHFHSA-N |