methyl N-[(1-oxoisoquinolin-2(1H)-yl)acetyl]glycinate
Chemical Structure Depiction of
methyl N-[(1-oxoisoquinolin-2(1H)-yl)acetyl]glycinate
methyl N-[(1-oxoisoquinolin-2(1H)-yl)acetyl]glycinate
Compound characteristics
| Compound ID: | C066-1223 |
| Compound Name: | methyl N-[(1-oxoisoquinolin-2(1H)-yl)acetyl]glycinate |
| Molecular Weight: | 274.27 |
| Molecular Formula: | C14 H14 N2 O4 |
| Smiles: | COC(CNC(CN1C=Cc2ccccc2C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3349 |
| logD: | 0.3349 |
| logSw: | -2.1832 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.003 |
| InChI Key: | UDMXZWVUSRJKTQ-UHFFFAOYSA-N |