3-fluorophenyl 2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
3-fluorophenyl 2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
3-fluorophenyl 2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | G817-1574 |
| Compound Name: | 3-fluorophenyl 2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 339.36 |
| Molecular Formula: | C20 H18 F N O3 |
| Smiles: | CC(C)CN1C=C(C(=O)Oc2cccc(c2)F)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.6479 |
| logD: | 3.6479 |
| logSw: | -4.0008 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.85 |
| InChI Key: | VSVHRTXJQBQTLP-UHFFFAOYSA-N |