N-{3-[(1,3-benzothiazol-2-yl)sulfanyl]-4-hydroxyphenyl}-2,5-dimethylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-{3-[(1,3-benzothiazol-2-yl)sulfanyl]-4-hydroxyphenyl}-2,5-dimethylbenzene-1-sulfonamide
N-{3-[(1,3-benzothiazol-2-yl)sulfanyl]-4-hydroxyphenyl}-2,5-dimethylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 3461-0312 |
| Compound Name: | N-{3-[(1,3-benzothiazol-2-yl)sulfanyl]-4-hydroxyphenyl}-2,5-dimethylbenzene-1-sulfonamide |
| Molecular Weight: | 442.58 |
| Molecular Formula: | C21 H18 N2 O3 S3 |
| Smiles: | Cc1ccc(C)c(c1)S(Nc1ccc(c(c1)Sc1nc2ccccc2s1)O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2354 |
| logD: | 6.1943 |
| logSw: | -5.3311 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.246 |
| InChI Key: | BODILRLAGGKQBA-UHFFFAOYSA-N |