2-{[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-4-(4-methylphenyl)phthalazin-1(2H)-one
Chemical Structure Depiction of
2-{[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-4-(4-methylphenyl)phthalazin-1(2H)-one
2-{[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-4-(4-methylphenyl)phthalazin-1(2H)-one
Compound characteristics
| Compound ID: | L100-0048 |
| Compound Name: | 2-{[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-4-(4-methylphenyl)phthalazin-1(2H)-one |
| Molecular Weight: | 438.49 |
| Molecular Formula: | C26 H22 N4 O3 |
| Smiles: | CCOc1ccc(cc1)c1nc(CN2C(c3ccccc3C(c3ccc(C)cc3)=N2)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 5.2182 |
| logD: | 5.2181 |
| logSw: | -5.0255 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.662 |
| InChI Key: | OQGXEMLYYHVYPY-UHFFFAOYSA-N |