2-[(furan-2-yl)methyl]-1-oxo-1,2-dihydroisoquinoline-4-carboxylic acid
Chemical Structure Depiction of
2-[(furan-2-yl)methyl]-1-oxo-1,2-dihydroisoquinoline-4-carboxylic acid
2-[(furan-2-yl)methyl]-1-oxo-1,2-dihydroisoquinoline-4-carboxylic acid
Compound characteristics
| Compound ID: | P773-1223 |
| Compound Name: | 2-[(furan-2-yl)methyl]-1-oxo-1,2-dihydroisoquinoline-4-carboxylic acid |
| Molecular Weight: | 269.25 |
| Molecular Formula: | C15 H11 N O4 |
| Smiles: | C(c1ccco1)N1C=C(C(O)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 0.9981 |
| logD: | -3.3066 |
| logSw: | -2.2184 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.357 |
| InChI Key: | WRJYWRDNCSIFEG-UHFFFAOYSA-N |