3-{2-[(4-fluorophenyl)methyl]-1,5-dioxo-1,2-dihydro[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl}-N-(2-methylpropyl)propanamide
Chemical Structure Depiction of
3-{2-[(4-fluorophenyl)methyl]-1,5-dioxo-1,2-dihydro[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl}-N-(2-methylpropyl)propanamide
3-{2-[(4-fluorophenyl)methyl]-1,5-dioxo-1,2-dihydro[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl}-N-(2-methylpropyl)propanamide
Compound characteristics
Compound ID: | L940-0163 |
Compound Name: | 3-{2-[(4-fluorophenyl)methyl]-1,5-dioxo-1,2-dihydro[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl}-N-(2-methylpropyl)propanamide |
Molecular Weight: | 437.47 |
Molecular Formula: | C23 H24 F N5 O3 |
Smiles: | CC(C)CNC(CCN1C2=NN(Cc3ccc(cc3)F)C(N2c2ccccc2C1=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.6914 |
logD: | 2.6914 |
logSw: | -3.3326 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.657 |
InChI Key: | PVALSMNAQDVZQW-UHFFFAOYSA-N |