3-[6-(3,4-dihydroisoquinolin-2(1H)-yl)-6-oxohexyl]-6,7-dimethoxyquinazoline-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-[6-(3,4-dihydroisoquinolin-2(1H)-yl)-6-oxohexyl]-6,7-dimethoxyquinazoline-2,4(1H,3H)-dione
3-[6-(3,4-dihydroisoquinolin-2(1H)-yl)-6-oxohexyl]-6,7-dimethoxyquinazoline-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C191-0323 |
| Compound Name: | 3-[6-(3,4-dihydroisoquinolin-2(1H)-yl)-6-oxohexyl]-6,7-dimethoxyquinazoline-2,4(1H,3H)-dione |
| Molecular Weight: | 451.52 |
| Molecular Formula: | C25 H29 N3 O5 |
| Smiles: | COc1cc2C(N(CCCCCC(N3CCc4ccccc4C3)=O)C(Nc2cc1OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2359 |
| logD: | 3.2197 |
| logSw: | -3.4716 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.774 |
| InChI Key: | VONMSMLPPCOUEI-UHFFFAOYSA-N |