N-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-7-oxoazepane-2-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-7-oxoazepane-2-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-7-oxoazepane-2-carboxamide
Compound characteristics
| Compound ID: | S513-0033 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-7-oxoazepane-2-carboxamide |
| Molecular Weight: | 334.41 |
| Molecular Formula: | C18 H26 N2 O4 |
| Smiles: | CN1C(CCCCC1=O)C(NCCc1ccc(c(c1)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7205 |
| logD: | 0.7205 |
| logSw: | -1.9474 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.532 |
| InChI Key: | NAFUMNQCLNCYBW-AWEZNQCLSA-N |