2-(4-chlorophenyl)-1-(2,5-dimethoxybenzene-1-sulfonyl)azepane
Chemical Structure Depiction of
2-(4-chlorophenyl)-1-(2,5-dimethoxybenzene-1-sulfonyl)azepane
2-(4-chlorophenyl)-1-(2,5-dimethoxybenzene-1-sulfonyl)azepane
Compound characteristics
Compound ID: | J005-0520 |
Compound Name: | 2-(4-chlorophenyl)-1-(2,5-dimethoxybenzene-1-sulfonyl)azepane |
Molecular Weight: | 409.93 |
Molecular Formula: | C20 H24 Cl N O4 S |
Smiles: | COc1ccc(c(c1)S(N1CCCCCC1c1ccc(cc1)[Cl])(=O)=O)OC |
Stereo: | RACEMIC MIXTURE |
logP: | 4.8232 |
logD: | 4.8232 |
logSw: | -5.1092 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 47.654 |
InChI Key: | FSCYVNRJXAMIBK-SFHVURJKSA-N |