N-[(2,5-dimethoxyphenyl)methyl]-1-methyl-7-oxoazepane-2-carboxamide
Chemical Structure Depiction of
N-[(2,5-dimethoxyphenyl)methyl]-1-methyl-7-oxoazepane-2-carboxamide
N-[(2,5-dimethoxyphenyl)methyl]-1-methyl-7-oxoazepane-2-carboxamide
Compound characteristics
| Compound ID: | S513-0058 |
| Compound Name: | N-[(2,5-dimethoxyphenyl)methyl]-1-methyl-7-oxoazepane-2-carboxamide |
| Molecular Weight: | 320.39 |
| Molecular Formula: | C17 H24 N2 O4 |
| Smiles: | CN1C(CCCCC1=O)C(NCc1cc(ccc1OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.23 |
| logD: | 1.23 |
| logSw: | -2.0094 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.604 |
| InChI Key: | NITAAZSSVWKPOT-AWEZNQCLSA-N |