1-(2,5-dimethoxybenzene-1-sulfonyl)-2-(3-methylthiophen-2-yl)azepane
Chemical Structure Depiction of
1-(2,5-dimethoxybenzene-1-sulfonyl)-2-(3-methylthiophen-2-yl)azepane
1-(2,5-dimethoxybenzene-1-sulfonyl)-2-(3-methylthiophen-2-yl)azepane
Compound characteristics
| Compound ID: | J005-0523 |
| Compound Name: | 1-(2,5-dimethoxybenzene-1-sulfonyl)-2-(3-methylthiophen-2-yl)azepane |
| Molecular Weight: | 395.54 |
| Molecular Formula: | C19 H25 N O4 S2 |
| Smiles: | Cc1ccsc1C1CCCCCN1S(c1cc(ccc1OC)OC)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4449 |
| logD: | 4.4449 |
| logSw: | -4.3151 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.672 |
| InChI Key: | ROFNUJQTHULHON-INIZCTEOSA-N |