8-methyl-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
8-methyl-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
8-methyl-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | E594-0451 |
| Compound Name: | 8-methyl-3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 318.33 |
| Molecular Formula: | C19 H14 N2 O3 |
| Smiles: | Cc1ccc(cc1)c1nc(C2=Cc3cccc(C)c3OC2=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.824 |
| logD: | 4.824 |
| logSw: | -4.8184 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.25 |
| InChI Key: | BIXLSYXSJTTYDT-UHFFFAOYSA-N |