ethyl 4-(2-{[1-(4-methylbenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}acetamido)piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-(2-{[1-(4-methylbenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}acetamido)piperidine-1-carboxylate
ethyl 4-(2-{[1-(4-methylbenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}acetamido)piperidine-1-carboxylate
Compound characteristics
Compound ID: | K653-0573 |
Compound Name: | ethyl 4-(2-{[1-(4-methylbenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}acetamido)piperidine-1-carboxylate |
Molecular Weight: | 516.64 |
Molecular Formula: | C24 H28 N4 O5 S2 |
Smiles: | CCOC(N1CCC(CC1)NC(CSc1nc2ccccc2n1S(c1ccc(C)cc1)(=O)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.9564 |
logD: | 3.9564 |
logSw: | -3.7674 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 83.841 |
InChI Key: | CMUWAHQAJVJFMY-UHFFFAOYSA-N |