1-(2,5-dimethylphenyl)-N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]methanesulfonamide
Chemical Structure Depiction of
1-(2,5-dimethylphenyl)-N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]methanesulfonamide
1-(2,5-dimethylphenyl)-N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]methanesulfonamide
Compound characteristics
| Compound ID: | M070-0143 |
| Compound Name: | 1-(2,5-dimethylphenyl)-N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]methanesulfonamide |
| Molecular Weight: | 378.53 |
| Molecular Formula: | C17 H18 N2 O2 S3 |
| Smiles: | Cc1ccc(C)c(CS(Nc2ccc3c(c2)sc(n3)SC)(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.5233 |
| logD: | 5.3635 |
| logSw: | -5.4171 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.597 |
| InChI Key: | BNFKIMCRFBVPHG-UHFFFAOYSA-N |