N-[2-(1H-imidazol-4-yl)ethyl]-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-[2-(1H-imidazol-4-yl)ethyl]-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-[2-(1H-imidazol-4-yl)ethyl]-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y041-8647 |
| Compound Name: | N-[2-(1H-imidazol-4-yl)ethyl]-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 282.3 |
| Molecular Formula: | C15 H14 N4 O2 |
| Smiles: | C(CNC(C1=CNC(c2ccccc12)=O)=O)c1c[nH]cn1 |
| Stereo: | ACHIRAL |
| logP: | 0.1837 |
| logD: | 0.1664 |
| logSw: | -2.1405 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 70.782 |
| InChI Key: | VPFDEKDMKFCSMP-UHFFFAOYSA-N |