3-(3-fluorophenyl)-8-[4-(pyridin-2-yl)piperazine-1-carbonyl][1,2,3]triazolo[1,5-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
3-(3-fluorophenyl)-8-[4-(pyridin-2-yl)piperazine-1-carbonyl][1,2,3]triazolo[1,5-a]quinazolin-5(4H)-one
3-(3-fluorophenyl)-8-[4-(pyridin-2-yl)piperazine-1-carbonyl][1,2,3]triazolo[1,5-a]quinazolin-5(4H)-one
Compound characteristics
Compound ID: | E543-0422 |
Compound Name: | 3-(3-fluorophenyl)-8-[4-(pyridin-2-yl)piperazine-1-carbonyl][1,2,3]triazolo[1,5-a]quinazolin-5(4H)-one |
Molecular Weight: | 469.48 |
Molecular Formula: | C25 H20 F N7 O2 |
Smiles: | C1CN(CCN1C(c1ccc2C(Nc3c(c4cccc(c4)F)nnn3c2c1)=O)=O)c1ccccn1 |
Stereo: | ACHIRAL |
logP: | 2.8285 |
logD: | 2.8189 |
logSw: | -3.5793 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 78.65 |
InChI Key: | LDIJRDIYURJDCT-UHFFFAOYSA-N |