1-benzyl-N-[(3,5-dimethoxyphenyl)methyl]-7-oxoazepane-2-carboxamide
Chemical Structure Depiction of
1-benzyl-N-[(3,5-dimethoxyphenyl)methyl]-7-oxoazepane-2-carboxamide
1-benzyl-N-[(3,5-dimethoxyphenyl)methyl]-7-oxoazepane-2-carboxamide
Compound characteristics
| Compound ID: | S513-0605 |
| Compound Name: | 1-benzyl-N-[(3,5-dimethoxyphenyl)methyl]-7-oxoazepane-2-carboxamide |
| Molecular Weight: | 396.49 |
| Molecular Formula: | C23 H28 N2 O4 |
| Smiles: | COc1cc(CNC(C2CCCCC(N2Cc2ccccc2)=O)=O)cc(c1)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9411 |
| logD: | 2.9411 |
| logSw: | -3.3441 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.48 |
| InChI Key: | MGOCGDGCCVTSAH-NRFANRHFSA-N |