4-chloro-N-{4-[1-(4-fluorophenyl)ethyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide
Chemical Structure Depiction of
4-chloro-N-{4-[1-(4-fluorophenyl)ethyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide
4-chloro-N-{4-[1-(4-fluorophenyl)ethyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide
Compound characteristics
| Compound ID: | V018-4986 |
| Compound Name: | 4-chloro-N-{4-[1-(4-fluorophenyl)ethyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide |
| Molecular Weight: | 438.88 |
| Molecular Formula: | C24 H20 Cl F N2 O3 |
| Smiles: | CC(c1ccc(cc1)F)N1Cc2cc(ccc2OCC1=O)NC(c1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5777 |
| logD: | 4.5762 |
| logSw: | -4.9713 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.175 |
| InChI Key: | XKUGVSDZQRQNIH-HNNXBMFYSA-N |