N-{3-[ethyl(phenyl)amino]propyl}-2-(1-oxoisoquinolin-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-{3-[ethyl(phenyl)amino]propyl}-2-(1-oxoisoquinolin-2(1H)-yl)acetamide
N-{3-[ethyl(phenyl)amino]propyl}-2-(1-oxoisoquinolin-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | C066-1045 |
| Compound Name: | N-{3-[ethyl(phenyl)amino]propyl}-2-(1-oxoisoquinolin-2(1H)-yl)acetamide |
| Molecular Weight: | 363.46 |
| Molecular Formula: | C22 H25 N3 O2 |
| Smiles: | CCN(CCCNC(CN1C=Cc2ccccc2C1=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.5848 |
| logD: | 2.5557 |
| logSw: | -3.1991 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.984 |
| InChI Key: | NBJCAOLHBYZIGY-UHFFFAOYSA-N |