N-{3-[ethyl(3-methylphenyl)amino]propyl}-N~2~-[(1-oxoisoquinolin-2(1H)-yl)acetyl]glycinamide
Chemical Structure Depiction of
N-{3-[ethyl(3-methylphenyl)amino]propyl}-N~2~-[(1-oxoisoquinolin-2(1H)-yl)acetyl]glycinamide
N-{3-[ethyl(3-methylphenyl)amino]propyl}-N~2~-[(1-oxoisoquinolin-2(1H)-yl)acetyl]glycinamide
Compound characteristics
| Compound ID: | C168-0120 |
| Compound Name: | N-{3-[ethyl(3-methylphenyl)amino]propyl}-N~2~-[(1-oxoisoquinolin-2(1H)-yl)acetyl]glycinamide |
| Molecular Weight: | 434.54 |
| Molecular Formula: | C25 H30 N4 O3 |
| Smiles: | CCN(CCCNC(CNC(CN1C=Cc2ccccc2C1=O)=O)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.7892 |
| logD: | 2.7569 |
| logSw: | -3.3447 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.455 |
| InChI Key: | OVVZHIGRLZHICR-UHFFFAOYSA-N |