2-cyclopropyl-1-oxo-1,2-dihydroisoquinoline-4-carboxylic acid
Chemical Structure Depiction of
2-cyclopropyl-1-oxo-1,2-dihydroisoquinoline-4-carboxylic acid
2-cyclopropyl-1-oxo-1,2-dihydroisoquinoline-4-carboxylic acid
Compound characteristics
| Compound ID: | Y041-3924 |
| Compound Name: | 2-cyclopropyl-1-oxo-1,2-dihydroisoquinoline-4-carboxylic acid |
| Molecular Weight: | 229.23 |
| Molecular Formula: | C13 H11 N O3 |
| Smiles: | C1CC1N1C=C(C(O)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 0.7387 |
| logD: | -3.8526 |
| logSw: | -2.0016 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.327 |
| InChI Key: | JNTBULPPLWKMKZ-UHFFFAOYSA-N |