N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({5-(4-methoxyphenyl)-2-[4-(methylsulfanyl)phenyl]-1H-imidazol-4-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({5-(4-methoxyphenyl)-2-[4-(methylsulfanyl)phenyl]-1H-imidazol-4-yl}sulfanyl)acetamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({5-(4-methoxyphenyl)-2-[4-(methylsulfanyl)phenyl]-1H-imidazol-4-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | C331-1958 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({5-(4-methoxyphenyl)-2-[4-(methylsulfanyl)phenyl]-1H-imidazol-4-yl}sulfanyl)acetamide |
| Molecular Weight: | 519.64 |
| Molecular Formula: | C27 H25 N3 O4 S2 |
| Smiles: | COc1ccc(cc1)c1c(nc(c2ccc(cc2)SC)[nH]1)SCC(Nc1ccc2c(c1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4182 |
| logD: | 5.4181 |
| logSw: | -5.4286 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.432 |
| InChI Key: | HCPBLGYHBNUBQI-UHFFFAOYSA-N |