1-(4-chlorophenyl)-2-{[1-(4-methylbenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-(4-chlorophenyl)-2-{[1-(4-methylbenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}ethan-1-one
1-(4-chlorophenyl)-2-{[1-(4-methylbenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | K653-0421 |
| Compound Name: | 1-(4-chlorophenyl)-2-{[1-(4-methylbenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 456.97 |
| Molecular Formula: | C22 H17 Cl N2 O3 S2 |
| Smiles: | Cc1ccc(cc1)S(n1c2ccccc2nc1SCC(c1ccc(cc1)[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.729 |
| logD: | 5.729 |
| logSw: | -6.0209 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 50.111 |
| InChI Key: | JCZZRRAEYLOTEY-UHFFFAOYSA-N |