phenyl 2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
phenyl 2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
phenyl 2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | G817-1593 |
| Compound Name: | phenyl 2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 321.37 |
| Molecular Formula: | C20 H19 N O3 |
| Smiles: | CC(C)CN1C=C(C(=O)Oc2ccccc2)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.5964 |
| logD: | 3.5964 |
| logSw: | -3.8077 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.85 |
| InChI Key: | KZHILULEPGANFB-UHFFFAOYSA-N |