methyl 4-(2-{[4-(benzenesulfonyl)-2-(4-methylphenyl)-1H-imidazol-5-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
methyl 4-(2-{[4-(benzenesulfonyl)-2-(4-methylphenyl)-1H-imidazol-5-yl]sulfanyl}acetamido)benzoate
methyl 4-(2-{[4-(benzenesulfonyl)-2-(4-methylphenyl)-1H-imidazol-5-yl]sulfanyl}acetamido)benzoate
Compound characteristics
| Compound ID: | D406-0441 |
| Compound Name: | methyl 4-(2-{[4-(benzenesulfonyl)-2-(4-methylphenyl)-1H-imidazol-5-yl]sulfanyl}acetamido)benzoate |
| Molecular Weight: | 521.61 |
| Molecular Formula: | C26 H23 N3 O5 S2 |
| Smiles: | Cc1ccc(cc1)c1nc(c([nH]1)SCC(Nc1ccc(cc1)C(=O)OC)=O)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4284 |
| logD: | 5.4009 |
| logSw: | -5.4551 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.786 |
| InChI Key: | LHEURVRBGMVYGH-UHFFFAOYSA-N |