N~2~-[(3-methyl-1-oxoisoquinolin-2(1H)-yl)acetyl]-N-[4-(propan-2-yl)phenyl]glycinamide
Chemical Structure Depiction of
N~2~-[(3-methyl-1-oxoisoquinolin-2(1H)-yl)acetyl]-N-[4-(propan-2-yl)phenyl]glycinamide
N~2~-[(3-methyl-1-oxoisoquinolin-2(1H)-yl)acetyl]-N-[4-(propan-2-yl)phenyl]glycinamide
Compound characteristics
| Compound ID: | C115-0116 |
| Compound Name: | N~2~-[(3-methyl-1-oxoisoquinolin-2(1H)-yl)acetyl]-N-[4-(propan-2-yl)phenyl]glycinamide |
| Molecular Weight: | 391.47 |
| Molecular Formula: | C23 H25 N3 O3 |
| Smiles: | CC(C)c1ccc(cc1)NC(CNC(CN1C(C)=Cc2ccccc2C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9747 |
| logD: | 3.9747 |
| logSw: | -4.1877 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.776 |
| InChI Key: | AIEMPCUSGRFGKS-UHFFFAOYSA-N |