1-(3,4-dimethylbenzene-1-sulfonyl)-2-(4-methylphenyl)azepane
Chemical Structure Depiction of
1-(3,4-dimethylbenzene-1-sulfonyl)-2-(4-methylphenyl)azepane
1-(3,4-dimethylbenzene-1-sulfonyl)-2-(4-methylphenyl)azepane
Compound characteristics
| Compound ID: | J005-0632 |
| Compound Name: | 1-(3,4-dimethylbenzene-1-sulfonyl)-2-(4-methylphenyl)azepane |
| Molecular Weight: | 357.51 |
| Molecular Formula: | C21 H27 N O2 S |
| Smiles: | Cc1ccc(cc1)C1CCCCCN1S(c1ccc(C)c(C)c1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8243 |
| logD: | 5.8243 |
| logSw: | -5.3815 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.48 |
| InChI Key: | KZUUMMIREXPQQZ-NRFANRHFSA-N |