methyl {3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-6-oxopyridazin-1(6H)-yl}acetate
Chemical Structure Depiction of
methyl {3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-6-oxopyridazin-1(6H)-yl}acetate
methyl {3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-6-oxopyridazin-1(6H)-yl}acetate
Compound characteristics
| Compound ID: | P040-0076 |
| Compound Name: | methyl {3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-6-oxopyridazin-1(6H)-yl}acetate |
| Molecular Weight: | 326.31 |
| Molecular Formula: | C16 H14 N4 O4 |
| Smiles: | Cc1ccc(cc1)c1nc(C2C=CC(N(CC(=O)OC)N=2)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.3225 |
| logD: | 2.3225 |
| logSw: | -2.6074 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 81.075 |
| InChI Key: | OWVASQNPULTKNV-UHFFFAOYSA-N |