N-[2-(4-chlorophenyl)ethyl]-4-{[2,4-dioxo-1-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-1,4-dihydroquinazolin-3(2H)-yl]methyl}benzamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-4-{[2,4-dioxo-1-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-1,4-dihydroquinazolin-3(2H)-yl]methyl}benzamide
N-[2-(4-chlorophenyl)ethyl]-4-{[2,4-dioxo-1-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-1,4-dihydroquinazolin-3(2H)-yl]methyl}benzamide
Compound characteristics
| Compound ID: | C260-0990 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-4-{[2,4-dioxo-1-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-1,4-dihydroquinazolin-3(2H)-yl]methyl}benzamide |
| Molecular Weight: | 635.04 |
| Molecular Formula: | C33 H26 Cl F3 N4 O4 |
| Smiles: | C(CNC(c1ccc(CN2C(c3ccccc3N(CC(Nc3cccc(c3)C(F)(F)F)=O)C2=O)=O)cc1)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.7884 |
| logD: | 5.788 |
| logSw: | -6.0731 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.671 |
| InChI Key: | QKIBSTHDBPNOQB-UHFFFAOYSA-N |