3-[3-(7-methoxy-2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]propanoic acid
Chemical Structure Depiction of
3-[3-(7-methoxy-2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]propanoic acid
3-[3-(7-methoxy-2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]propanoic acid
Compound characteristics
| Compound ID: | 8020-5004 |
| Compound Name: | 3-[3-(7-methoxy-2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]propanoic acid |
| Molecular Weight: | 292.25 |
| Molecular Formula: | C13 H12 N2 O6 |
| Smiles: | COc1cc(cc2c1OCO2)c1nc(CCC(O)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 1.8053 |
| logD: | -1.0342 |
| logSw: | -1.7851 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.395 |
| InChI Key: | YHQZKATUSRTEBH-UHFFFAOYSA-N |