2-chloro-6-methyl-N-[2-(propylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
Chemical Structure Depiction of
2-chloro-6-methyl-N-[2-(propylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
2-chloro-6-methyl-N-[2-(propylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | M070-1957 |
| Compound Name: | 2-chloro-6-methyl-N-[2-(propylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide |
| Molecular Weight: | 412.98 |
| Molecular Formula: | C17 H17 Cl N2 O2 S3 |
| Smiles: | CCCSc1nc2ccc(cc2s1)NS(c1c(C)cccc1[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7447 |
| logD: | 5.3039 |
| logSw: | -6.0458 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.97 |
| InChI Key: | SHMYXNLMQQJYLA-UHFFFAOYSA-N |