2-{3-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropyl]-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl}-N-(3-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-{3-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropyl]-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl}-N-(3-methoxyphenyl)acetamide
2-{3-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropyl]-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl}-N-(3-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C260-1681 |
| Compound Name: | 2-{3-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropyl]-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl}-N-(3-methoxyphenyl)acetamide |
| Molecular Weight: | 512.57 |
| Molecular Formula: | C29 H28 N4 O5 |
| Smiles: | COc1cccc(c1)NC(CN1C(N(CCC(N2CCc3ccccc3C2)=O)C(c2ccccc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3877 |
| logD: | 3.3877 |
| logSw: | -3.8314 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.993 |
| InChI Key: | MWOPHZJEJXNTMK-UHFFFAOYSA-N |