6-methoxy-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-methoxy-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
6-methoxy-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | E594-0086 |
| Compound Name: | 6-methoxy-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 334.33 |
| Molecular Formula: | C19 H14 N2 O4 |
| Smiles: | Cc1ccc(cc1)c1nc(C2=Cc3cc(ccc3OC2=O)OC)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.2513 |
| logD: | 4.2513 |
| logSw: | -4.5187 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.11 |
| InChI Key: | JEBWAKTWWJJZCE-UHFFFAOYSA-N |