3-chloro-4-methoxy-N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
Chemical Structure Depiction of
3-chloro-4-methoxy-N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
3-chloro-4-methoxy-N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | M070-0087 |
| Compound Name: | 3-chloro-4-methoxy-N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide |
| Molecular Weight: | 400.92 |
| Molecular Formula: | C15 H13 Cl N2 O3 S3 |
| Smiles: | COc1ccc(cc1[Cl])S(Nc1ccc2c(c1)sc(n2)SC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3728 |
| logD: | 4.3581 |
| logSw: | -4.5354 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.6 |
| InChI Key: | PHQQSHGYBNOCPC-UHFFFAOYSA-N |