N-{3-[(1,3-benzothiazol-2-yl)sulfanyl]-4-hydroxyphenyl}-2,5-dimethoxybenzene-1-sulfonamide
Chemical Structure Depiction of
N-{3-[(1,3-benzothiazol-2-yl)sulfanyl]-4-hydroxyphenyl}-2,5-dimethoxybenzene-1-sulfonamide
N-{3-[(1,3-benzothiazol-2-yl)sulfanyl]-4-hydroxyphenyl}-2,5-dimethoxybenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 7202-0447 |
| Compound Name: | N-{3-[(1,3-benzothiazol-2-yl)sulfanyl]-4-hydroxyphenyl}-2,5-dimethoxybenzene-1-sulfonamide |
| Molecular Weight: | 474.58 |
| Molecular Formula: | C21 H18 N2 O5 S3 |
| Smiles: | COc1ccc(c(c1)S(Nc1ccc(c(c1)Sc1nc2ccccc2s1)O)(=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 5.296 |
| logD: | 5.2549 |
| logSw: | -5.2191 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.42 |
| InChI Key: | CXULTUJYCXFFAJ-UHFFFAOYSA-N |