2-[(1,3-benzothiazol-2-yl)sulfanyl]-N-{4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl}acetamide
Chemical Structure Depiction of
2-[(1,3-benzothiazol-2-yl)sulfanyl]-N-{4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl}acetamide
2-[(1,3-benzothiazol-2-yl)sulfanyl]-N-{4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl}acetamide
Compound characteristics
| Compound ID: | 3163-0045 |
| Compound Name: | 2-[(1,3-benzothiazol-2-yl)sulfanyl]-N-{4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl}acetamide |
| Molecular Weight: | 517.6 |
| Molecular Formula: | C21 H19 N5 O5 S3 |
| Smiles: | COc1cc(NS(c2ccc(cc2)NC(CSc2nc3ccccc3s2)=O)(=O)=O)nc(n1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.1866 |
| logD: | 1.059 |
| logSw: | -4.2933 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.774 |
| InChI Key: | TVFAOAMCIKSKCX-UHFFFAOYSA-N |