7-bromo-N-(2,6-dimethylphenyl)-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
7-bromo-N-(2,6-dimethylphenyl)-1-benzoxepine-4-carboxamide
7-bromo-N-(2,6-dimethylphenyl)-1-benzoxepine-4-carboxamide
Compound characteristics
Compound ID: | D443-0408 |
Compound Name: | 7-bromo-N-(2,6-dimethylphenyl)-1-benzoxepine-4-carboxamide |
Molecular Weight: | 370.24 |
Molecular Formula: | C19 H16 Br N O2 |
Smiles: | Cc1cccc(C)c1NC(C1C=COc2ccc(cc2C=1)[Br])=O |
Stereo: | ACHIRAL |
logP: | 4.8675 |
logD: | 4.8675 |
logSw: | -4.6978 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 27.5586 |
InChI Key: | JMECBXYNXDQARC-UHFFFAOYSA-N |