N-[2-(4-chlorophenyl)ethyl]-4-{2,4-dioxo-1-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,4-dihydroquinazolin-3(2H)-yl}butanamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-4-{2,4-dioxo-1-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,4-dihydroquinazolin-3(2H)-yl}butanamide
N-[2-(4-chlorophenyl)ethyl]-4-{2,4-dioxo-1-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,4-dihydroquinazolin-3(2H)-yl}butanamide
Compound characteristics
| Compound ID: | C260-1643 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-4-{2,4-dioxo-1-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,4-dihydroquinazolin-3(2H)-yl}butanamide |
| Molecular Weight: | 544.01 |
| Molecular Formula: | C29 H26 Cl N5 O4 |
| Smiles: | C(CC(NCCc1ccc(cc1)[Cl])=O)CN1C(c2ccccc2N(CC2=CC(N3C=CC=CC3=N2)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8968 |
| logD: | 1.8968 |
| logSw: | -3.3071 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.545 |
| InChI Key: | XACQOXAQWLTSTB-UHFFFAOYSA-N |