N-[(2-chlorophenyl)methyl]-2-{3-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropyl]-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl}acetamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-2-{3-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropyl]-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl}acetamide
N-[(2-chlorophenyl)methyl]-2-{3-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropyl]-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl}acetamide
Compound characteristics
| Compound ID: | C260-1138 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-2-{3-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxopropyl]-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl}acetamide |
| Molecular Weight: | 531.01 |
| Molecular Formula: | C29 H27 Cl N4 O4 |
| Smiles: | C(CN1C(c2ccccc2N(CC(NCc2ccccc2[Cl])=O)C1=O)=O)C(N1CCc2ccccc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.681 |
| logD: | 3.681 |
| logSw: | -4.1519 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.771 |
| InChI Key: | SRUVJNYVKDSZIO-UHFFFAOYSA-N |