N-[(2-fluorophenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
Chemical Structure Depiction of
N-[(2-fluorophenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
N-[(2-fluorophenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
Compound characteristics
| Compound ID: | M400-0184 |
| Compound Name: | N-[(2-fluorophenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide |
| Molecular Weight: | 336.79 |
| Molecular Formula: | C17 H17 F N2 O2 |
| Salt: | HCl |
| Smiles: | C1COc2ccc(cc2CN1)C(NCc1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4578 |
| logD: | 1.1297 |
| logSw: | -2.9815 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 44.746 |
| InChI Key: | BQOCBBPFSCQPBQ-UHFFFAOYSA-N |