4,7-dimethoxy-2-({[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl}sulfanyl)-1H-benzimidazole
Chemical Structure Depiction of
4,7-dimethoxy-2-({[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl}sulfanyl)-1H-benzimidazole
4,7-dimethoxy-2-({[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl}sulfanyl)-1H-benzimidazole
Compound characteristics
Compound ID: | 8019-3973 |
Compound Name: | 4,7-dimethoxy-2-({[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl}sulfanyl)-1H-benzimidazole |
Molecular Weight: | 458.49 |
Molecular Formula: | C21 H22 N4 O6 S |
Smiles: | COc1cc(cc(c1OC)OC)c1nnc(CSc2nc3c(ccc(c3[nH]2)OC)OC)o1 |
Stereo: | ACHIRAL |
logP: | 2.4974 |
logD: | 2.4642 |
logSw: | -2.8688 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 87.941 |
InChI Key: | HNFOLKWEOJFYMH-UHFFFAOYSA-N |