3-chloro-4-methoxy-N-[2-(propylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
Chemical Structure Depiction of
3-chloro-4-methoxy-N-[2-(propylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
3-chloro-4-methoxy-N-[2-(propylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | M070-1990 |
| Compound Name: | 3-chloro-4-methoxy-N-[2-(propylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide |
| Molecular Weight: | 428.98 |
| Molecular Formula: | C17 H17 Cl N2 O3 S3 |
| Smiles: | CCCSc1nc2ccc(cc2s1)NS(c1ccc(c(c1)[Cl])OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1271 |
| logD: | 5.1124 |
| logSw: | -5.6735 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.6 |
| InChI Key: | AYJOUVCVAXMKKS-UHFFFAOYSA-N |