N-(4-fluorophenyl)-2-{4-[(4-methylphenyl)methyl]-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl}acetamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-2-{4-[(4-methylphenyl)methyl]-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl}acetamide
N-(4-fluorophenyl)-2-{4-[(4-methylphenyl)methyl]-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl}acetamide
Compound characteristics
| Compound ID: | F365-0187 |
| Compound Name: | N-(4-fluorophenyl)-2-{4-[(4-methylphenyl)methyl]-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl}acetamide |
| Molecular Weight: | 457.46 |
| Molecular Formula: | C25 H20 F N5 O3 |
| Smiles: | Cc1ccc(CN2C3=NN(CC(Nc4ccc(cc4)F)=O)C(N3c3ccccc3C2=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0601 |
| logD: | 4.0601 |
| logSw: | -4.2346 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.085 |
| InChI Key: | NYYMUXWRCOQTII-UHFFFAOYSA-N |