3-methoxyphenyl 2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
3-methoxyphenyl 2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
3-methoxyphenyl 2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | G817-1600 |
| Compound Name: | 3-methoxyphenyl 2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 351.4 |
| Molecular Formula: | C21 H21 N O4 |
| Smiles: | CC(C)CN1C=C(C(=O)Oc2cccc(c2)OC)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.5865 |
| logD: | 3.5865 |
| logSw: | -3.8784 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.393 |
| InChI Key: | ZBDIYVUPCFJJEY-UHFFFAOYSA-N |