N-{3-[(1,3-benzothiazol-2-yl)sulfanyl]-4-hydroxyphenyl}-4-chloro-3-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-{3-[(1,3-benzothiazol-2-yl)sulfanyl]-4-hydroxyphenyl}-4-chloro-3-methylbenzene-1-sulfonamide
N-{3-[(1,3-benzothiazol-2-yl)sulfanyl]-4-hydroxyphenyl}-4-chloro-3-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 5591-3584 |
| Compound Name: | N-{3-[(1,3-benzothiazol-2-yl)sulfanyl]-4-hydroxyphenyl}-4-chloro-3-methylbenzene-1-sulfonamide |
| Molecular Weight: | 462.99 |
| Molecular Formula: | C20 H15 Cl N2 O3 S3 |
| Smiles: | Cc1cc(ccc1[Cl])S(Nc1ccc(c(c1)Sc1nc2ccccc2s1)O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6414 |
| logD: | 6.6003 |
| logSw: | -5.9374 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.246 |
| InChI Key: | YFGDFURNAZJIEL-UHFFFAOYSA-N |