1-(2,5-dimethylbenzene-1-sulfonyl)-2-(4-methylphenyl)azepane
Chemical Structure Depiction of
1-(2,5-dimethylbenzene-1-sulfonyl)-2-(4-methylphenyl)azepane
1-(2,5-dimethylbenzene-1-sulfonyl)-2-(4-methylphenyl)azepane
Compound characteristics
| Compound ID: | J005-0481 |
| Compound Name: | 1-(2,5-dimethylbenzene-1-sulfonyl)-2-(4-methylphenyl)azepane |
| Molecular Weight: | 357.51 |
| Molecular Formula: | C21 H27 N O2 S |
| Smiles: | Cc1ccc(cc1)C1CCCCCN1S(c1cc(C)ccc1C)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5912 |
| logD: | 5.5912 |
| logSw: | -5.2783 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.48 |
| InChI Key: | ZHFJRWOPGAVPAG-FQEVSTJZSA-N |