2-[2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]phthalazin-1(2H)-one
Chemical Structure Depiction of
2-[2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]phthalazin-1(2H)-one
2-[2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]phthalazin-1(2H)-one
Compound characteristics
| Compound ID: | Y041-0918 |
| Compound Name: | 2-[2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]phthalazin-1(2H)-one |
| Molecular Weight: | 379.41 |
| Molecular Formula: | C21 H21 N3 O4 |
| Smiles: | COc1cc2CCN(Cc2cc1OC)C(CN1C(c2ccccc2C=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2914 |
| logD: | 1.2914 |
| logSw: | -2.3451 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.545 |
| InChI Key: | XYDNRONWNASMGE-UHFFFAOYSA-N |