propan-2-yl {3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-6-oxopyridazin-1(6H)-yl}acetate
Chemical Structure Depiction of
propan-2-yl {3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-6-oxopyridazin-1(6H)-yl}acetate
propan-2-yl {3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-6-oxopyridazin-1(6H)-yl}acetate
Compound characteristics
| Compound ID: | P040-0078 |
| Compound Name: | propan-2-yl {3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-6-oxopyridazin-1(6H)-yl}acetate |
| Molecular Weight: | 354.36 |
| Molecular Formula: | C18 H18 N4 O4 |
| Smiles: | CC(C)OC(CN1C(C=CC(c2nc(c3ccc(C)cc3)no2)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0667 |
| logD: | 3.0667 |
| logSw: | -3.0328 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 80.334 |
| InChI Key: | YDHIRQFGZZZIFL-UHFFFAOYSA-N |