2-{2-[4-(4-acetylphenyl)piperazin-1-yl]-2-oxoethyl}isoquinolin-1(2H)-one
Chemical Structure Depiction of
2-{2-[4-(4-acetylphenyl)piperazin-1-yl]-2-oxoethyl}isoquinolin-1(2H)-one
2-{2-[4-(4-acetylphenyl)piperazin-1-yl]-2-oxoethyl}isoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | C066-1389 |
| Compound Name: | 2-{2-[4-(4-acetylphenyl)piperazin-1-yl]-2-oxoethyl}isoquinolin-1(2H)-one |
| Molecular Weight: | 389.45 |
| Molecular Formula: | C23 H23 N3 O3 |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)C(CN1C=Cc2ccccc2C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7083 |
| logD: | 1.7083 |
| logSw: | -2.5071 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.161 |
| InChI Key: | FEXXMEONMFIWCH-UHFFFAOYSA-N |