N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-2,5-dimethoxybenzene-1-sulfonamide
Chemical Structure Depiction of
N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-2,5-dimethoxybenzene-1-sulfonamide
N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-2,5-dimethoxybenzene-1-sulfonamide
Compound characteristics
| Compound ID: | M071-0222 |
| Compound Name: | N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-2,5-dimethoxybenzene-1-sulfonamide |
| Molecular Weight: | 428.5 |
| Molecular Formula: | C16 H16 N2 O6 S3 |
| Smiles: | COc1ccc(c(c1)S(Nc1ccc2c(c1)sc(n2)S(C)(=O)=O)(=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.3863 |
| logD: | 2.2536 |
| logSw: | -3.0663 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.306 |
| InChI Key: | PFIAKMGDJSAIIZ-UHFFFAOYSA-N |