3,4-dimethyl-N-[2-(propylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
Chemical Structure Depiction of
3,4-dimethyl-N-[2-(propylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
3,4-dimethyl-N-[2-(propylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | M070-1987 |
| Compound Name: | 3,4-dimethyl-N-[2-(propylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide |
| Molecular Weight: | 392.56 |
| Molecular Formula: | C18 H20 N2 O2 S3 |
| Smiles: | CCCSc1nc2ccc(cc2s1)NS(c1ccc(C)c(C)c1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8757 |
| logD: | 5.7456 |
| logSw: | -5.5242 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.97 |
| InChI Key: | JIIZEYFHRBRQEJ-UHFFFAOYSA-N |