2-(4-ethoxyphenyl)-4-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]isoquinolin-1(2H)-one
Chemical Structure Depiction of
2-(4-ethoxyphenyl)-4-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]isoquinolin-1(2H)-one
2-(4-ethoxyphenyl)-4-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]isoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | F982-0142 |
| Compound Name: | 2-(4-ethoxyphenyl)-4-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]isoquinolin-1(2H)-one |
| Molecular Weight: | 423.47 |
| Molecular Formula: | C26 H21 N3 O3 |
| Smiles: | CCOc1ccc(cc1)N1C=C(c2ccccc2C1=O)c1nc(c2ccccc2C)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.8747 |
| logD: | 4.8747 |
| logSw: | -4.616 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.284 |
| InChI Key: | ZPTYLQBPWNUQBF-UHFFFAOYSA-N |