N-[2-(ethylsulfanyl)-1,3-benzothiazol-6-yl]-2,5-dimethylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-[2-(ethylsulfanyl)-1,3-benzothiazol-6-yl]-2,5-dimethylbenzene-1-sulfonamide
N-[2-(ethylsulfanyl)-1,3-benzothiazol-6-yl]-2,5-dimethylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | M070-0221 |
| Compound Name: | N-[2-(ethylsulfanyl)-1,3-benzothiazol-6-yl]-2,5-dimethylbenzene-1-sulfonamide |
| Molecular Weight: | 378.53 |
| Molecular Formula: | C17 H18 N2 O2 S3 |
| Smiles: | CCSc1nc2ccc(cc2s1)NS(c1cc(C)ccc1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3934 |
| logD: | 4.9527 |
| logSw: | -5.3443 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.97 |
| InChI Key: | JWTNZZCEFWUGLK-UHFFFAOYSA-N |