4-({2,4-dioxo-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,4-dihydroquinazolin-3(2H)-yl}methyl)-N-[(4-methylphenyl)methyl]benzamide
Chemical Structure Depiction of
4-({2,4-dioxo-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,4-dihydroquinazolin-3(2H)-yl}methyl)-N-[(4-methylphenyl)methyl]benzamide
4-({2,4-dioxo-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,4-dihydroquinazolin-3(2H)-yl}methyl)-N-[(4-methylphenyl)methyl]benzamide
Compound characteristics
| Compound ID: | C260-2763 |
| Compound Name: | 4-({2,4-dioxo-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,4-dihydroquinazolin-3(2H)-yl}methyl)-N-[(4-methylphenyl)methyl]benzamide |
| Molecular Weight: | 601.71 |
| Molecular Formula: | C36 H35 N5 O4 |
| Smiles: | Cc1ccc(CNC(c2ccc(CN3C(c4ccccc4N(CC(N4CCN(CC4)c4ccccc4)=O)C3=O)=O)cc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.204 |
| logD: | 4.2039 |
| logSw: | -4.2207 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.333 |
| InChI Key: | NOMGZCPKNKFGKV-UHFFFAOYSA-N |