3-fluoro-N-{4-[(3-methoxyphenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide
Chemical Structure Depiction of
3-fluoro-N-{4-[(3-methoxyphenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide
3-fluoro-N-{4-[(3-methoxyphenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide
Compound characteristics
| Compound ID: | V014-5754 |
| Compound Name: | 3-fluoro-N-{4-[(3-methoxyphenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide |
| Molecular Weight: | 420.44 |
| Molecular Formula: | C24 H21 F N2 O4 |
| Smiles: | COc1cccc(CN2Cc3cc(ccc3OCC2=O)NC(c2cccc(c2)F)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.2996 |
| logD: | 3.2982 |
| logSw: | -3.576 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.212 |
| InChI Key: | CHAMWLAPMRLXPG-UHFFFAOYSA-N |