N-(4-bromo-2-fluorophenyl)-2-{[1-(4-methylbenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-bromo-2-fluorophenyl)-2-{[1-(4-methylbenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}acetamide
N-(4-bromo-2-fluorophenyl)-2-{[1-(4-methylbenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | K781-1367 |
| Compound Name: | N-(4-bromo-2-fluorophenyl)-2-{[1-(4-methylbenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 534.42 |
| Molecular Formula: | C22 H17 Br F N3 O3 S2 |
| Smiles: | Cc1ccc(cc1)S(n1c2ccccc2nc1SCC(Nc1ccc(cc1F)[Br])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6876 |
| logD: | 5.6798 |
| logSw: | -5.3593 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.315 |
| InChI Key: | UCSVOHHKOLGRID-UHFFFAOYSA-N |