4-bromo-N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
Chemical Structure Depiction of
4-bromo-N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
4-bromo-N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | M071-0178 |
| Compound Name: | 4-bromo-N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide |
| Molecular Weight: | 447.35 |
| Molecular Formula: | C14 H11 Br N2 O4 S3 |
| Smiles: | CS(c1nc2ccc(cc2s1)NS(c1ccc(cc1)[Br])(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3938 |
| logD: | 2.7928 |
| logSw: | -3.8706 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.132 |
| InChI Key: | XGASSXPBJWNZDD-UHFFFAOYSA-N |