2-bromo-N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-5-methoxybenzamide
Chemical Structure Depiction of
2-bromo-N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-5-methoxybenzamide
2-bromo-N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-5-methoxybenzamide
Compound characteristics
| Compound ID: | M073-0016 |
| Compound Name: | 2-bromo-N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-5-methoxybenzamide |
| Molecular Weight: | 455.35 |
| Molecular Formula: | C17 H15 Br N2 O4 S2 |
| Smiles: | CCS(c1nc2ccc(cc2s1)NC(c1cc(ccc1[Br])OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9185 |
| logD: | 3.9143 |
| logSw: | -4.1498 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.405 |
| InChI Key: | DTCDAVOQGSTJGO-UHFFFAOYSA-N |