7-bromo-N-(2,5-dimethoxyphenyl)-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
7-bromo-N-(2,5-dimethoxyphenyl)-1-benzoxepine-4-carboxamide
7-bromo-N-(2,5-dimethoxyphenyl)-1-benzoxepine-4-carboxamide
Compound characteristics
| Compound ID: | D443-0389 |
| Compound Name: | 7-bromo-N-(2,5-dimethoxyphenyl)-1-benzoxepine-4-carboxamide |
| Molecular Weight: | 402.24 |
| Molecular Formula: | C19 H16 Br N O4 |
| Smiles: | COc1ccc(c(c1)NC(C1C=COc2ccc(cc2C=1)[Br])=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.7018 |
| logD: | 4.7005 |
| logSw: | -4.5379 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.431 |
| InChI Key: | GYRLPUCVLGQWEA-UHFFFAOYSA-N |