4-{[3-(3,4-dimethylphenyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]methyl}-N-{[3-(trifluoromethyl)phenyl]methyl}benzamide
Chemical Structure Depiction of
4-{[3-(3,4-dimethylphenyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]methyl}-N-{[3-(trifluoromethyl)phenyl]methyl}benzamide
4-{[3-(3,4-dimethylphenyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]methyl}-N-{[3-(trifluoromethyl)phenyl]methyl}benzamide
Compound characteristics
| Compound ID: | V009-8533 |
| Compound Name: | 4-{[3-(3,4-dimethylphenyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]methyl}-N-{[3-(trifluoromethyl)phenyl]methyl}benzamide |
| Molecular Weight: | 557.57 |
| Molecular Formula: | C32 H26 F3 N3 O3 |
| Smiles: | Cc1ccc(cc1C)N1C(c2ccccc2N(Cc2ccc(cc2)C(NCc2cccc(c2)C(F)(F)F)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9243 |
| logD: | 5.9243 |
| logSw: | -5.6704 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.069 |
| InChI Key: | PYUZCDHUQINHGV-UHFFFAOYSA-N |