propyl 2-(3-methylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
propyl 2-(3-methylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
propyl 2-(3-methylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | L867-0058 |
| Compound Name: | propyl 2-(3-methylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 321.37 |
| Molecular Formula: | C20 H19 N O3 |
| Smiles: | CCCOC(C1=CN(C(c2ccccc12)=O)c1cccc(C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7245 |
| logD: | 3.7245 |
| logSw: | -3.9024 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.802 |
| InChI Key: | KFQBOHZIDCXQQS-UHFFFAOYSA-N |