3-[3-(2,3-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-8-ethoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[3-(2,3-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-8-ethoxy-2H-1-benzopyran-2-one
3-[3-(2,3-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-8-ethoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | E594-0239 |
| Compound Name: | 3-[3-(2,3-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-8-ethoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 394.38 |
| Molecular Formula: | C21 H18 N2 O6 |
| Smiles: | CCOc1cccc2C=C(C(=O)Oc12)c1nc(c2cccc(c2OC)OC)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.8495 |
| logD: | 3.8495 |
| logSw: | -4.1533 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 74.808 |
| InChI Key: | BVUOIXSITYZNTG-UHFFFAOYSA-N |