2-(3-methylphenyl)-N-(3,4,5-trimethoxyphenyl)azepane-1-carboxamide
Chemical Structure Depiction of
2-(3-methylphenyl)-N-(3,4,5-trimethoxyphenyl)azepane-1-carboxamide
2-(3-methylphenyl)-N-(3,4,5-trimethoxyphenyl)azepane-1-carboxamide
Compound characteristics
| Compound ID: | J007-0668 |
| Compound Name: | 2-(3-methylphenyl)-N-(3,4,5-trimethoxyphenyl)azepane-1-carboxamide |
| Molecular Weight: | 398.5 |
| Molecular Formula: | C23 H30 N2 O4 |
| Smiles: | Cc1cccc(c1)C1CCCCCN1C(Nc1cc(c(c(c1)OC)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4053 |
| logD: | 4.4053 |
| logSw: | -4.2091 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.439 |
| InChI Key: | IXXPBVMVZGSRQO-IBGZPJMESA-N |