3-{4-[(2-chlorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-(4-fluorophenyl)propanamide
Chemical Structure Depiction of
3-{4-[(2-chlorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-(4-fluorophenyl)propanamide
3-{4-[(2-chlorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-(4-fluorophenyl)propanamide
Compound characteristics
| Compound ID: | C741-0666 |
| Compound Name: | 3-{4-[(2-chlorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-(4-fluorophenyl)propanamide |
| Molecular Weight: | 475.91 |
| Molecular Formula: | C25 H19 Cl F N5 O2 |
| Smiles: | C(Cc1nnc2N(Cc3ccccc3[Cl])C(c3ccccc3n12)=O)C(Nc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7122 |
| logD: | 3.712 |
| logSw: | -4.2799 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.856 |
| InChI Key: | KZDOBOAJICUJEE-UHFFFAOYSA-N |