N-{4-[(4-chlorophenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-3-fluorobenzamide
Chemical Structure Depiction of
N-{4-[(4-chlorophenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-3-fluorobenzamide
N-{4-[(4-chlorophenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-3-fluorobenzamide
Compound characteristics
| Compound ID: | V020-6797 |
| Compound Name: | N-{4-[(4-chlorophenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-3-fluorobenzamide |
| Molecular Weight: | 424.86 |
| Molecular Formula: | C23 H18 Cl F N2 O3 |
| Smiles: | C(c1ccc(cc1)[Cl])N1Cc2cc(ccc2OCC1=O)NC(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8389 |
| logD: | 3.8376 |
| logSw: | -4.5248 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.668 |
| InChI Key: | AXSYUWNDINRDBF-UHFFFAOYSA-N |