N-(3-chlorophenyl)-2-{4-[(4-fluorophenyl)methyl]-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl}acetamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-2-{4-[(4-fluorophenyl)methyl]-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl}acetamide
N-(3-chlorophenyl)-2-{4-[(4-fluorophenyl)methyl]-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl}acetamide
Compound characteristics
| Compound ID: | F365-0162 |
| Compound Name: | N-(3-chlorophenyl)-2-{4-[(4-fluorophenyl)methyl]-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl}acetamide |
| Molecular Weight: | 477.88 |
| Molecular Formula: | C24 H17 Cl F N5 O3 |
| Smiles: | C(c1ccc(cc1)F)N1C2=NN(CC(Nc3cccc(c3)[Cl])=O)C(N2c2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3903 |
| logD: | 4.3902 |
| logSw: | -4.5339 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.085 |
| InChI Key: | NEHOQFOZJUOBJE-UHFFFAOYSA-N |