6-methoxy-3-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-methoxy-3-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
6-methoxy-3-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | E594-0259 |
| Compound Name: | 6-methoxy-3-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 410.38 |
| Molecular Formula: | C21 H18 N2 O7 |
| Smiles: | COc1ccc2c(C=C(C(=O)O2)c2nc(c3cc(c(c(c3)OC)OC)OC)no2)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.3103 |
| logD: | 3.3103 |
| logSw: | -3.7049 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 83.088 |
| InChI Key: | YJOQJWMFRZHHLD-UHFFFAOYSA-N |