N-(2,6-dimethylphenyl)-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
N-(2,6-dimethylphenyl)-1-benzoxepine-4-carboxamide
N-(2,6-dimethylphenyl)-1-benzoxepine-4-carboxamide
Compound characteristics
| Compound ID: | D443-0107 |
| Compound Name: | N-(2,6-dimethylphenyl)-1-benzoxepine-4-carboxamide |
| Molecular Weight: | 291.35 |
| Molecular Formula: | C19 H17 N O2 |
| Smiles: | Cc1cccc(C)c1NC(C1C=COc2ccccc2C=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1282 |
| logD: | 4.1282 |
| logSw: | -4.4019 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.5586 |
| InChI Key: | YDLUYZKQOVOMHF-UHFFFAOYSA-N |