methyl 2-(2-{[4-(4-methylbenzene-1-sulfonyl)-2-phenyl-1H-imidazol-5-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
methyl 2-(2-{[4-(4-methylbenzene-1-sulfonyl)-2-phenyl-1H-imidazol-5-yl]sulfanyl}acetamido)benzoate
methyl 2-(2-{[4-(4-methylbenzene-1-sulfonyl)-2-phenyl-1H-imidazol-5-yl]sulfanyl}acetamido)benzoate
Compound characteristics
| Compound ID: | D406-0483 |
| Compound Name: | methyl 2-(2-{[4-(4-methylbenzene-1-sulfonyl)-2-phenyl-1H-imidazol-5-yl]sulfanyl}acetamido)benzoate |
| Molecular Weight: | 521.61 |
| Molecular Formula: | C26 H23 N3 O5 S2 |
| Smiles: | Cc1ccc(cc1)S(c1c([nH]c(c2ccccc2)n1)SCC(Nc1ccccc1C(=O)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1422 |
| logD: | 5.1137 |
| logSw: | -5.0298 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.088 |
| InChI Key: | IIDFUVHRPCBBBN-UHFFFAOYSA-N |