4-propoxyphenyl 2-(4-methylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
4-propoxyphenyl 2-(4-methylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
4-propoxyphenyl 2-(4-methylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | G817-0107 |
| Compound Name: | 4-propoxyphenyl 2-(4-methylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 413.47 |
| Molecular Formula: | C26 H23 N O4 |
| Smiles: | CCCOc1ccc(cc1)OC(C1=CN(C(c2ccccc12)=O)c1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.069 |
| logD: | 5.069 |
| logSw: | -4.765 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.55 |
| InChI Key: | QTJJRFCAHCSMHZ-UHFFFAOYSA-N |