3,4-dimethoxy-N-[2-(propane-1-sulfonyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
Chemical Structure Depiction of
3,4-dimethoxy-N-[2-(propane-1-sulfonyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
3,4-dimethoxy-N-[2-(propane-1-sulfonyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | M071-0457 |
| Compound Name: | 3,4-dimethoxy-N-[2-(propane-1-sulfonyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide |
| Molecular Weight: | 456.56 |
| Molecular Formula: | C18 H20 N2 O6 S3 |
| Smiles: | CCCS(c1nc2ccc(cc2s1)NS(c1ccc(c(c1)OC)OC)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1753 |
| logD: | 3.1603 |
| logSw: | -3.4925 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.68 |
| InChI Key: | NRFZJPQRKYHKHT-UHFFFAOYSA-N |