N-(1-benzylpiperidin-4-yl)-3-{2,4-dioxo-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,4-dihydroquinazolin-3(2H)-yl}propanamide
Chemical Structure Depiction of
N-(1-benzylpiperidin-4-yl)-3-{2,4-dioxo-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,4-dihydroquinazolin-3(2H)-yl}propanamide
N-(1-benzylpiperidin-4-yl)-3-{2,4-dioxo-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,4-dihydroquinazolin-3(2H)-yl}propanamide
Compound characteristics
| Compound ID: | C260-1044 |
| Compound Name: | N-(1-benzylpiperidin-4-yl)-3-{2,4-dioxo-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,4-dihydroquinazolin-3(2H)-yl}propanamide |
| Molecular Weight: | 608.74 |
| Molecular Formula: | C35 H40 N6 O4 |
| Smiles: | C1CN(CCC1NC(CCN1C(c2ccccc2N(CC(N2CCN(CC2)c2ccccc2)=O)C1=O)=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.7296 |
| logD: | 1.1719 |
| logSw: | -3.488 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.635 |
| InChI Key: | IKQKGDLDRAXOSX-UHFFFAOYSA-N |