2-(1-oxoisoquinolin-2(1H)-yl)-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]acetamide
Chemical Structure Depiction of
2-(1-oxoisoquinolin-2(1H)-yl)-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]acetamide
2-(1-oxoisoquinolin-2(1H)-yl)-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]acetamide
Compound characteristics
| Compound ID: | C168-0056 |
| Compound Name: | 2-(1-oxoisoquinolin-2(1H)-yl)-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]acetamide |
| Molecular Weight: | 404.47 |
| Molecular Formula: | C23 H24 N4 O3 |
| Smiles: | C(C(N1CCN(CC1)c1ccccc1)=O)NC(CN1C=Cc2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5925 |
| logD: | 1.5925 |
| logSw: | -2.5079 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.806 |
| InChI Key: | IUFLJTCJNDCERZ-UHFFFAOYSA-N |