3-[3-(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]propanoic acid
Chemical Structure Depiction of
3-[3-(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]propanoic acid
3-[3-(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]propanoic acid
Compound characteristics
| Compound ID: | 8020-4266 |
| Compound Name: | 3-[3-(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]propanoic acid |
| Molecular Weight: | 322.27 |
| Molecular Formula: | C14 H14 N2 O7 |
| Smiles: | COc1c(cc2c(c1OC)OCO2)c1nc(CCC(O)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.0825 |
| logD: | -0.7571 |
| logSw: | -2.3974 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.199 |
| InChI Key: | LCWZONJAFPAILG-UHFFFAOYSA-N |