N-benzyl-7-methyl-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
N-benzyl-7-methyl-1-benzoxepine-4-carboxamide
N-benzyl-7-methyl-1-benzoxepine-4-carboxamide
Compound characteristics
| Compound ID: | D547-0075 |
| Compound Name: | N-benzyl-7-methyl-1-benzoxepine-4-carboxamide |
| Molecular Weight: | 291.35 |
| Molecular Formula: | C19 H17 N O2 |
| Smiles: | Cc1ccc2c(C=C(C=CO2)C(NCc2ccccc2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.0982 |
| logD: | 4.0982 |
| logSw: | -4.2889 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.2764 |
| InChI Key: | SYSARVQDQMYSPQ-UHFFFAOYSA-N |