1-(5-bromothiophene-2-sulfonyl)-2-(4-methylphenyl)azepane
Chemical Structure Depiction of
1-(5-bromothiophene-2-sulfonyl)-2-(4-methylphenyl)azepane
1-(5-bromothiophene-2-sulfonyl)-2-(4-methylphenyl)azepane
Compound characteristics
| Compound ID: | J005-0578 |
| Compound Name: | 1-(5-bromothiophene-2-sulfonyl)-2-(4-methylphenyl)azepane |
| Molecular Weight: | 414.38 |
| Molecular Formula: | C17 H20 Br N O2 S2 |
| Smiles: | Cc1ccc(cc1)C1CCCCCN1S(c1ccc(s1)[Br])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3586 |
| logD: | 5.3586 |
| logSw: | -5.2365 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.498 |
| InChI Key: | DDNNFFJTSYNZIA-HNNXBMFYSA-N |