N-[2-(azepan-1-yl)-2-(thiophen-2-yl)ethyl]-4-methylbenzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[2-(azepan-1-yl)-2-(thiophen-2-yl)ethyl]-4-methylbenzamide--hydrogen chloride (1/1)
N-[2-(azepan-1-yl)-2-(thiophen-2-yl)ethyl]-4-methylbenzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D388-0639 |
| Compound Name: | N-[2-(azepan-1-yl)-2-(thiophen-2-yl)ethyl]-4-methylbenzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 378.96 |
| Molecular Formula: | C20 H26 N2 O S |
| Salt: | HCl |
| Smiles: | [H]N(CC(c1cccs1)N1CCCCCC1)C(c1ccc(C)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9659 |
| logD: | 3.8177 |
| logSw: | -3.8811 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.9905 |
| InChI Key: | TYMVPQCFKSWLKQ-SFHVURJKSA-N |