N-[2-(azepan-1-yl)-2-(4-methoxyphenyl)ethyl]-3,4,5-trimethoxybenzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[2-(azepan-1-yl)-2-(4-methoxyphenyl)ethyl]-3,4,5-trimethoxybenzamide--hydrogen chloride (1/1)
N-[2-(azepan-1-yl)-2-(4-methoxyphenyl)ethyl]-3,4,5-trimethoxybenzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D345-0702 |
| Compound Name: | N-[2-(azepan-1-yl)-2-(4-methoxyphenyl)ethyl]-3,4,5-trimethoxybenzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 479.02 |
| Molecular Formula: | C25 H34 N2 O5 |
| Salt: | HCl |
| Smiles: | [H]N(CC(c1ccc(cc1)OC)N1CCCCCC1)C(c1cc(c(c(c1)OC)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6585 |
| logD: | 3.5293 |
| logSw: | -3.8725 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.494 |
| InChI Key: | SQRUOTULCLASPN-NRFANRHFSA-N |