3-(2H-1,3-benzodioxol-5-yl)-3'-(3,4,5-trimethoxyphenyl)-5,5'-bi-1,2,4-oxadiazole
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-3'-(3,4,5-trimethoxyphenyl)-5,5'-bi-1,2,4-oxadiazole
3-(2H-1,3-benzodioxol-5-yl)-3'-(3,4,5-trimethoxyphenyl)-5,5'-bi-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | S360-0242 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-3'-(3,4,5-trimethoxyphenyl)-5,5'-bi-1,2,4-oxadiazole |
| Molecular Weight: | 424.37 |
| Molecular Formula: | C20 H16 N4 O7 |
| Smiles: | COc1cc(cc(c1OC)OC)c1nc(c2nc(c3ccc4c(c3)OCO4)no2)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.9832 |
| logD: | 3.9832 |
| logSw: | -4.2537 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 103.415 |
| InChI Key: | FFJIRLIKTNQMCM-UHFFFAOYSA-N |