1-(3,4-dimethoxybenzene-1-sulfonyl)-2-(thiophen-2-yl)azepane
Chemical Structure Depiction of
1-(3,4-dimethoxybenzene-1-sulfonyl)-2-(thiophen-2-yl)azepane
1-(3,4-dimethoxybenzene-1-sulfonyl)-2-(thiophen-2-yl)azepane
Compound characteristics
| Compound ID: | J005-0544 |
| Compound Name: | 1-(3,4-dimethoxybenzene-1-sulfonyl)-2-(thiophen-2-yl)azepane |
| Molecular Weight: | 381.51 |
| Molecular Formula: | C18 H23 N O4 S2 |
| Smiles: | COc1ccc(cc1OC)S(N1CCCCCC1c1cccs1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6294 |
| logD: | 3.6294 |
| logSw: | -3.8403 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.759 |
| InChI Key: | RZXZWWCDEYSRKL-HNNXBMFYSA-N |