4-bromo-N-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]benzamide
Chemical Structure Depiction of
4-bromo-N-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]benzamide
4-bromo-N-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]benzamide
Compound characteristics
| Compound ID: | M073-0712 |
| Compound Name: | 4-bromo-N-[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]benzamide |
| Molecular Weight: | 439.35 |
| Molecular Formula: | C17 H15 Br N2 O3 S2 |
| Smiles: | CC(C)S(c1nc2ccc(cc2s1)NC(c1ccc(cc1)[Br])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5836 |
| logD: | 4.5669 |
| logSw: | -4.4455 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.597 |
| InChI Key: | WVIIPHXMCNMNSN-UHFFFAOYSA-N |