2-(3-methoxyphenyl)-4-[4-(pyridin-2-yl)piperazine-1-carbonyl]isoquinolin-1(2H)-one
Chemical Structure Depiction of
2-(3-methoxyphenyl)-4-[4-(pyridin-2-yl)piperazine-1-carbonyl]isoquinolin-1(2H)-one
2-(3-methoxyphenyl)-4-[4-(pyridin-2-yl)piperazine-1-carbonyl]isoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | E456-2112 |
| Compound Name: | 2-(3-methoxyphenyl)-4-[4-(pyridin-2-yl)piperazine-1-carbonyl]isoquinolin-1(2H)-one |
| Molecular Weight: | 440.5 |
| Molecular Formula: | C26 H24 N4 O3 |
| Smiles: | COc1cccc(c1)N1C=C(C(N2CCN(CC2)c2ccccn2)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.2344 |
| logD: | 3.2256 |
| logSw: | -3.5304 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.718 |
| InChI Key: | TZWSAZFYEBFZGB-UHFFFAOYSA-N |