2-phenyl-N-[2-(propane-1-sulfonyl)-1,3-benzothiazol-6-yl]ethane-1-sulfonamide
Chemical Structure Depiction of
2-phenyl-N-[2-(propane-1-sulfonyl)-1,3-benzothiazol-6-yl]ethane-1-sulfonamide
2-phenyl-N-[2-(propane-1-sulfonyl)-1,3-benzothiazol-6-yl]ethane-1-sulfonamide
Compound characteristics
| Compound ID: | M071-0526 |
| Compound Name: | 2-phenyl-N-[2-(propane-1-sulfonyl)-1,3-benzothiazol-6-yl]ethane-1-sulfonamide |
| Molecular Weight: | 424.56 |
| Molecular Formula: | C18 H20 N2 O4 S3 |
| Smiles: | CCCS(c1nc2ccc(cc2s1)NS(CCc1ccccc1)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8975 |
| logD: | 3.6821 |
| logSw: | -3.9714 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.047 |
| InChI Key: | BIAPTMRNSBSZPC-UHFFFAOYSA-N |