N-(4-bromo-2-fluorophenyl)-2-{[1-(3-nitrobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-bromo-2-fluorophenyl)-2-{[1-(3-nitrobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}acetamide
N-(4-bromo-2-fluorophenyl)-2-{[1-(3-nitrobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | K781-1370 |
| Compound Name: | N-(4-bromo-2-fluorophenyl)-2-{[1-(3-nitrobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 565.39 |
| Molecular Formula: | C21 H14 Br F N4 O5 S2 |
| Smiles: | C(C(Nc1ccc(cc1F)[Br])=O)Sc1nc2ccccc2n1S(c1cccc(c1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1246 |
| logD: | 5.1168 |
| logSw: | -5.3513 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.697 |
| InChI Key: | FPFQVHYWBYLKMC-UHFFFAOYSA-N |