2-{[1-(4-bromobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}-N-(5-chloro-2,4-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[1-(4-bromobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}-N-(5-chloro-2,4-dimethoxyphenyl)acetamide
2-{[1-(4-bromobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}-N-(5-chloro-2,4-dimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | K653-0643 |
| Compound Name: | 2-{[1-(4-bromobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}-N-(5-chloro-2,4-dimethoxyphenyl)acetamide |
| Molecular Weight: | 596.9 |
| Molecular Formula: | C23 H19 Br Cl N3 O5 S2 |
| Smiles: | COc1cc(c(cc1NC(CSc1nc2ccccc2n1S(c1ccc(cc1)[Br])(=O)=O)=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 5.7164 |
| logD: | 5.7092 |
| logSw: | -5.91 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.576 |
| InChI Key: | AJSHTKYQWNLHLF-UHFFFAOYSA-N |