5-bromo-N-[2-(propane-1-sulfonyl)-1,3-benzothiazol-6-yl]thiophene-2-sulfonamide
Chemical Structure Depiction of
5-bromo-N-[2-(propane-1-sulfonyl)-1,3-benzothiazol-6-yl]thiophene-2-sulfonamide
5-bromo-N-[2-(propane-1-sulfonyl)-1,3-benzothiazol-6-yl]thiophene-2-sulfonamide
Compound characteristics
| Compound ID: | M071-0460 |
| Compound Name: | 5-bromo-N-[2-(propane-1-sulfonyl)-1,3-benzothiazol-6-yl]thiophene-2-sulfonamide |
| Molecular Weight: | 481.43 |
| Molecular Formula: | C14 H13 Br N2 O4 S4 |
| Smiles: | CCCS(c1nc2ccc(cc2s1)NS(c1ccc(s1)[Br])(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3505 |
| logD: | 4.2403 |
| logSw: | -4.3303 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.438 |
| InChI Key: | DJLTXDKIXJVDNW-UHFFFAOYSA-N |