N-(2H-1,3-benzodioxol-5-yl)-2-{[2-(4-ethoxy-3-methoxyphenyl)-5-(4-methoxyphenyl)-1H-imidazol-4-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-{[2-(4-ethoxy-3-methoxyphenyl)-5-(4-methoxyphenyl)-1H-imidazol-4-yl]sulfanyl}acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-{[2-(4-ethoxy-3-methoxyphenyl)-5-(4-methoxyphenyl)-1H-imidazol-4-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | C331-1894 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-{[2-(4-ethoxy-3-methoxyphenyl)-5-(4-methoxyphenyl)-1H-imidazol-4-yl]sulfanyl}acetamide |
| Molecular Weight: | 533.6 |
| Molecular Formula: | C28 H27 N3 O6 S |
| Smiles: | CCOc1ccc(cc1OC)c1nc(c(c2ccc(cc2)OC)[nH]1)SCC(Nc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5705 |
| logD: | 5.5702 |
| logSw: | -5.4018 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.564 |
| InChI Key: | AQRQJIOALFIJHO-UHFFFAOYSA-N |