propyl 2-(4-ethylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
propyl 2-(4-ethylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
propyl 2-(4-ethylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | L867-0241 |
| Compound Name: | propyl 2-(4-ethylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 335.4 |
| Molecular Formula: | C21 H21 N O3 |
| Smiles: | CCCOC(C1=CN(C(c2ccccc12)=O)c1ccc(CC)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1415 |
| logD: | 4.1415 |
| logSw: | -4.2481 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.802 |
| InChI Key: | ZKGVUWHJQKOECE-UHFFFAOYSA-N |