1-(3-chloro-4-methoxybenzene-1-sulfonyl)-2-(4-methylphenyl)azepane
Chemical Structure Depiction of
1-(3-chloro-4-methoxybenzene-1-sulfonyl)-2-(4-methylphenyl)azepane
1-(3-chloro-4-methoxybenzene-1-sulfonyl)-2-(4-methylphenyl)azepane
Compound characteristics
| Compound ID: | J005-0668 |
| Compound Name: | 1-(3-chloro-4-methoxybenzene-1-sulfonyl)-2-(4-methylphenyl)azepane |
| Molecular Weight: | 393.93 |
| Molecular Formula: | C20 H24 Cl N O3 S |
| Smiles: | Cc1ccc(cc1)C1CCCCCN1S(c1ccc(c(c1)[Cl])OC)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0758 |
| logD: | 5.0758 |
| logSw: | -5.5499 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.11 |
| InChI Key: | NODOFZKIWWLQOC-IBGZPJMESA-N |