3,5-dimethylphenyl 2-ethyl-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
3,5-dimethylphenyl 2-ethyl-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
3,5-dimethylphenyl 2-ethyl-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | G817-1498 |
| Compound Name: | 3,5-dimethylphenyl 2-ethyl-1-oxo-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 321.37 |
| Molecular Formula: | C20 H19 N O3 |
| Smiles: | CCN1C=C(C(=O)Oc2cc(C)cc(C)c2)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.4688 |
| logD: | 3.4688 |
| logSw: | -3.7588 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.574 |
| InChI Key: | AGNVRBYBVBWITI-UHFFFAOYSA-N |