N-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-2-(3-methyl-1-oxoisoquinolin-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-2-(3-methyl-1-oxoisoquinolin-2(1H)-yl)acetamide
N-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-2-(3-methyl-1-oxoisoquinolin-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | C115-0104 |
| Compound Name: | N-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-2-(3-methyl-1-oxoisoquinolin-2(1H)-yl)acetamide |
| Molecular Weight: | 448.52 |
| Molecular Formula: | C25 H28 N4 O4 |
| Smiles: | CC1=Cc2ccccc2C(N1CC(NCC(N1CCN(CC1)c1ccc(cc1)OC)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3557 |
| logD: | 2.3552 |
| logSw: | -2.9857 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.823 |
| InChI Key: | STIRDXLKHQXVFI-UHFFFAOYSA-N |