2-bromo-N-{2-[2-(5-chloro-2-methylanilino)-2-oxoethanesulfonyl]-1,3-benzothiazol-6-yl}benzamide
Chemical Structure Depiction of
2-bromo-N-{2-[2-(5-chloro-2-methylanilino)-2-oxoethanesulfonyl]-1,3-benzothiazol-6-yl}benzamide
2-bromo-N-{2-[2-(5-chloro-2-methylanilino)-2-oxoethanesulfonyl]-1,3-benzothiazol-6-yl}benzamide
Compound characteristics
| Compound ID: | 8012-8706 |
| Compound Name: | 2-bromo-N-{2-[2-(5-chloro-2-methylanilino)-2-oxoethanesulfonyl]-1,3-benzothiazol-6-yl}benzamide |
| Molecular Weight: | 578.89 |
| Molecular Formula: | C23 H17 Br Cl N3 O4 S2 |
| Smiles: | Cc1ccc(cc1NC(CS(c1nc2ccc(cc2s1)NC(c1ccccc1[Br])=O)(=O)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.7581 |
| logD: | 4.7414 |
| logSw: | -4.7749 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.041 |
| InChI Key: | MNENEDBFVFGZDS-UHFFFAOYSA-N |