3-{[3-(4-chlorobenzene-1-sulfonyl)benzene-1-sulfonyl]amino}benzoic acid
Chemical Structure Depiction of
3-{[3-(4-chlorobenzene-1-sulfonyl)benzene-1-sulfonyl]amino}benzoic acid
3-{[3-(4-chlorobenzene-1-sulfonyl)benzene-1-sulfonyl]amino}benzoic acid
Compound characteristics
Compound ID: | 0668-0017 |
Compound Name: | 3-{[3-(4-chlorobenzene-1-sulfonyl)benzene-1-sulfonyl]amino}benzoic acid |
Molecular Weight: | 451.9 |
Molecular Formula: | C19 H14 Cl N O6 S2 |
Smiles: | c1cc(cc(c1)NS(c1cccc(c1)S(c1ccc(cc1)[Cl])(=O)=O)(=O)=O)C(O)=O |
Stereo: | ACHIRAL |
logP: | 4.4747 |
logD: | 1.7245 |
logSw: | -4.4958 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 98.797 |
InChI Key: | ZJOOXWFRQRHJMG-UHFFFAOYSA-N |