N-{3-[(1,3-benzothiazol-2-yl)sulfanyl]-4-hydroxyphenyl}-5-tert-butyl-2,3-dimethylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-{3-[(1,3-benzothiazol-2-yl)sulfanyl]-4-hydroxyphenyl}-5-tert-butyl-2,3-dimethylbenzene-1-sulfonamide
N-{3-[(1,3-benzothiazol-2-yl)sulfanyl]-4-hydroxyphenyl}-5-tert-butyl-2,3-dimethylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 7202-0445 |
| Compound Name: | N-{3-[(1,3-benzothiazol-2-yl)sulfanyl]-4-hydroxyphenyl}-5-tert-butyl-2,3-dimethylbenzene-1-sulfonamide |
| Molecular Weight: | 498.68 |
| Molecular Formula: | C25 H26 N2 O3 S3 |
| Smiles: | Cc1cc(cc(c1C)S(Nc1ccc(c(c1)Sc1nc2ccccc2s1)O)(=O)=O)C(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 8.038 |
| logD: | 7.9968 |
| logSw: | -5.5927 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.246 |
| InChI Key: | QCDKROPDNLFEOT-UHFFFAOYSA-N |