4-fluoro-N-{4-[2-(4-methoxyphenyl)ethyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide
Chemical Structure Depiction of
4-fluoro-N-{4-[2-(4-methoxyphenyl)ethyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide
4-fluoro-N-{4-[2-(4-methoxyphenyl)ethyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide
Compound characteristics
| Compound ID: | V018-0239 |
| Compound Name: | 4-fluoro-N-{4-[2-(4-methoxyphenyl)ethyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide |
| Molecular Weight: | 434.47 |
| Molecular Formula: | C25 H23 F N2 O4 |
| Smiles: | COc1ccc(CCN2Cc3cc(ccc3OCC2=O)NC(c2ccc(cc2)F)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4399 |
| logD: | 3.4384 |
| logSw: | -3.7003 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.19 |
| InChI Key: | CINPAYYPEUTSQP-UHFFFAOYSA-N |