ethyl 4-(2-{[1-(4-bromobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}acetamido)piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-(2-{[1-(4-bromobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}acetamido)piperidine-1-carboxylate
ethyl 4-(2-{[1-(4-bromobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}acetamido)piperidine-1-carboxylate
Compound characteristics
| Compound ID: | K653-0586 |
| Compound Name: | ethyl 4-(2-{[1-(4-bromobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}acetamido)piperidine-1-carboxylate |
| Molecular Weight: | 581.51 |
| Molecular Formula: | C23 H25 Br N4 O5 S2 |
| Smiles: | CCOC(N1CCC(CC1)NC(CSc1nc2ccccc2n1S(c1ccc(cc1)[Br])(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3669 |
| logD: | 4.3669 |
| logSw: | -4.0582 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.841 |
| InChI Key: | ARLIDHQOTOTXOZ-UHFFFAOYSA-N |