4-{[1-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]methyl}-N-[(4-methylphenyl)methyl]benzamide
Chemical Structure Depiction of
4-{[1-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]methyl}-N-[(4-methylphenyl)methyl]benzamide
4-{[1-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]methyl}-N-[(4-methylphenyl)methyl]benzamide
Compound characteristics
| Compound ID: | C260-2753 |
| Compound Name: | 4-{[1-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]methyl}-N-[(4-methylphenyl)methyl]benzamide |
| Molecular Weight: | 620.71 |
| Molecular Formula: | C36 H36 N4 O6 |
| Smiles: | Cc1ccc(CNC(c2ccc(CN3C(c4ccccc4N(CC(NCCc4ccc(c(c4)OC)OC)=O)C3=O)=O)cc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.5098 |
| logD: | 3.5098 |
| logSw: | -3.7663 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.254 |
| InChI Key: | JKIWOAQJTQDTDA-UHFFFAOYSA-N |