6-methyl-3-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-methyl-3-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
6-methyl-3-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | E594-0485 |
| Compound Name: | 6-methyl-3-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 394.38 |
| Molecular Formula: | C21 H18 N2 O6 |
| Smiles: | Cc1ccc2c(C=C(C(=O)O2)c2nc(c3cc(c(c(c3)OC)OC)OC)no2)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.6612 |
| logD: | 3.6612 |
| logSw: | -3.9775 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.544 |
| InChI Key: | YTCOAEGRZROLLY-UHFFFAOYSA-N |