2-(4-methoxyphenyl)-N-[(oxan-4-yl)methyl]-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-(4-methoxyphenyl)-N-[(oxan-4-yl)methyl]-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
2-(4-methoxyphenyl)-N-[(oxan-4-yl)methyl]-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y041-5646 |
| Compound Name: | 2-(4-methoxyphenyl)-N-[(oxan-4-yl)methyl]-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 392.45 |
| Molecular Formula: | C23 H24 N2 O4 |
| Smiles: | COc1ccc(cc1)N1C=C(C(NCC2CCOCC2)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.2319 |
| logD: | 2.2319 |
| logSw: | -2.8091 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.812 |
| InChI Key: | DBDAYTQSDDTXGS-UHFFFAOYSA-N |