N-(4-bromo-2-fluorophenyl)-2-(thiophen-2-yl)azepane-1-carboxamide
Chemical Structure Depiction of
N-(4-bromo-2-fluorophenyl)-2-(thiophen-2-yl)azepane-1-carboxamide
N-(4-bromo-2-fluorophenyl)-2-(thiophen-2-yl)azepane-1-carboxamide
Compound characteristics
| Compound ID: | J007-0474 |
| Compound Name: | N-(4-bromo-2-fluorophenyl)-2-(thiophen-2-yl)azepane-1-carboxamide |
| Molecular Weight: | 397.31 |
| Molecular Formula: | C17 H18 Br F N2 O S |
| Smiles: | C1CCC(c2cccs2)N(CC1)C(Nc1ccc(cc1F)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2089 |
| logD: | 5.2087 |
| logSw: | -5.2206 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 25.7815 |
| InChI Key: | OWXFLTQEOJRQMM-HNNXBMFYSA-N |