N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2,5-dimethoxybenzene-1-sulfonamide
Chemical Structure Depiction of
N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2,5-dimethoxybenzene-1-sulfonamide
N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2,5-dimethoxybenzene-1-sulfonamide
Compound characteristics
Compound ID: | L319-0374 |
Compound Name: | N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2,5-dimethoxybenzene-1-sulfonamide |
Molecular Weight: | 440.54 |
Molecular Formula: | C22 H20 N2 O4 S2 |
Smiles: | Cc1cc(ccc1NS(c1cc(ccc1OC)OC)(=O)=O)c1nc2ccccc2s1 |
Stereo: | ACHIRAL |
logP: | 5.007 |
logD: | 5.0036 |
logSw: | -4.7272 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 64.813 |
InChI Key: | MQJPBGZULQYWLU-UHFFFAOYSA-N |