N-(4-bromophenyl)-8-methyl-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
N-(4-bromophenyl)-8-methyl-1-benzoxepine-4-carboxamide
N-(4-bromophenyl)-8-methyl-1-benzoxepine-4-carboxamide
Compound characteristics
| Compound ID: | D547-0138 |
| Compound Name: | N-(4-bromophenyl)-8-methyl-1-benzoxepine-4-carboxamide |
| Molecular Weight: | 356.22 |
| Molecular Formula: | C18 H14 Br N O2 |
| Smiles: | Cc1ccc2C=C(C=COc2c1)C(Nc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.5113 |
| logD: | 5.511 |
| logSw: | -5.3946 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.9542 |
| InChI Key: | OREAFSILGYXFDX-UHFFFAOYSA-N |